#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jbf n ALA 3 N 0.00 0.87 -1.77 3.55 0.00 -1.26 -4.94 120.51 116.97 2jbf n ALA 3 Ca 0.00 0.20 -0.40 0.00 0.00 0.00 0.00 53.44 53.24 2jbf n ALA 3 Cb 0.00 -2.21 -0.02 0.00 0.00 0.00 0.00 19.45 17.22 2jbf n ALA 3 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2jbf s PRO 4 N -2.33 4.30 0.00 0.00 0.04 -1.26 -4.94 135.00 130.80 2jbf s PRO 4 Ca 0.65 2.03 0.17 0.00 0.04 0.00 0.00 61.00 63.90 2jbf s PRO 4 Cb -0.49 -2.96 0.06 0.00 0.04 0.00 0.00 34.50 31.15 2jbf s PRO 4 CO 0.55 -0.17 0.97 0.39 0.04 0.00 0.00 177.00 178.77 2jbf n GLU 5 N 0.62 1.56 -3.54 4.56 -0.58 -1.26 -4.97 120.64 117.03 2jbf n GLU 5 Ca 0.01 -1.18 -0.15 0.00 -0.42 0.00 0.00 57.16 55.42 2jbf n GLU 5 Cb 0.44 -1.32 -0.05 0.00 -0.57 0.00 0.00 31.44 29.94 2jbf n GLU 5 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jbf s ALA 6 N -1.74 -1.51 0.57 0.62 0.00 -1.26 -5.16 121.76 113.29 2jbf s ALA 6 Ca 0.17 0.81 -0.17 0.00 0.00 0.00 0.00 51.96 52.77 2jbf s ALA 6 Cb 0.14 0.33 -0.04 0.00 0.00 0.00 0.00 23.12 23.55 2jbf s ALA 6 CO 0.33 -0.50 1.07 -1.25 0.00 0.00 0.00 175.76 175.41 2jbf s PRO 7 N -2.22 3.36 0.67 0.00 0.04 -1.26 -5.05 135.00 130.54 2jbf s PRO 7 Ca -0.06 1.30 -0.10 0.00 0.04 0.00 0.00 61.00 62.17 2jbf s PRO 7 Cb -0.01 -2.03 0.01 0.00 0.04 0.00 0.00 34.50 32.51 2jbf s PRO 7 CO 0.00 -0.79 1.05 0.95 0.04 0.00 0.00 177.00 178.25 2jbf s THR 8 N -2.27 3.69 -0.23 1.26 -4.23 -1.26 -5.06 115.64 107.53 2jbf s THR 8 Ca 0.66 0.44 -0.11 0.00 -1.18 0.00 0.00 61.69 61.49 2jbf s THR 8 Cb -0.17 -3.53 -0.05 0.00 1.34 0.00 0.00 72.50 70.09 2jbf s THR 8 CO 0.33 -0.67 0.19 -0.44 -0.54 0.00 0.00 174.62 173.50 2jbf s SER 9 N -4.32 6.18 0.00 3.99 0.01 -1.26 -5.09 113.70 113.21 2jbf s SER 9 Ca 0.57 0.19 -0.14 0.00 1.31 0.00 0.00 55.95 57.88 2jbf s SER 9 Cb -0.11 -2.12 -0.06 0.00 0.21 0.00 0.00 66.02 63.94 2jbf s SER 9 CO 0.51 0.06 0.39 0.28 0.41 0.00 0.00 173.24 174.88 2jbf s THR 10 N 1.01 5.07 0.10 1.44 -1.32 -1.26 -4.98 115.64 115.70 2jbf s THR 10 Ca 0.09 0.75 -0.30 0.00 -1.21 0.00 0.00 61.69 61.02 2jbf s THR 10 Cb -0.13 -3.68 -0.06 0.00 -1.51 0.00 0.00 72.50 67.11 2jbf s THR 10 CO 0.04 0.54 1.11 -0.22 -2.21 0.00 0.00 174.62 173.88 2jbf s LEU 11 N -1.20 4.42 0.79 9.08 2.96 -1.26 -5.03 118.68 128.45 2jbf s LEU 11 Ca 0.24 1.97 -0.11 0.00 -0.22 0.00 0.00 54.13 56.02 2jbf s LEU 11 Cb -0.16 -3.59 0.07 0.00 0.50 0.00 0.00 46.19 43.01 2jbf s LEU 11 CO 0.13 -0.31 1.11 -2.16 -1.32 0.00 0.00 176.35 173.80 2jbf s PRO 12 N 0.43 2.07 0.25 0.98 0.04 -1.26 -4.94 135.00 132.56 2jbf s PRO 12 Ca 0.53 1.29 -0.31 0.00 0.04 0.00 0.00 61.00 62.55 2jbf s PRO 12 Cb -0.28 -1.87 -0.13 0.00 0.04 0.00 0.00 34.50 32.26 2jbf s PRO 12 CO 0.31 -1.80 1.39 -2.30 0.04 0.00 0.00 177.00 174.64 2jbf n PRO 13 N -3.52 2.04 -1.98 0.56 -0.02 -1.26 -4.72 135.00 126.10 2jbf n PRO 13 Ca 0.10 0.72 -0.41 0.00 -2.02 0.00 0.00 63.50 61.89 2jbf n PRO 13 Cb 0.53 -2.37 -0.02 0.00 -0.02 0.00 0.00 33.50 31.62 2jbf n PRO 13 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2jbf s GLU 14 N -0.57 4.25 -0.47 -0.52 2.12 -1.26 -4.44 118.70 117.81 2jbf s GLU 14 Ca 0.67 2.36 0.03 0.00 0.36 0.00 0.00 54.97 58.38 2jbf s GLU 14 Cb -0.64 -3.05 0.15 0.00 0.26 0.00 0.00 34.13 30.85 2jbf s GLU 14 CO 0.51 -0.36 0.30 1.03 -0.54 0.00 0.00 175.26 176.19 2jbf s ARG 15 N -1.49 1.34 0.22 4.30 0.52 -0.00 -4.98 118.95 118.86 2jbf s ARG 15 Ca 0.53 -2.18 -0.32 0.00 -0.52 0.00 0.00 55.73 53.24 2jbf s ARG 15 Cb -0.43 -2.24 -0.13 0.00 0.52 0.00 0.00 34.95 32.67 2jbf s ARG 15 CO 0.53 -1.23 1.55 -2.30 0.02 0.00 0.00 175.30 173.88 2jbf n PRO 16 N 3.20 2.35 -3.02 3.54 -0.02 -1.26 -1.99 135.00 137.80 2jbf n PRO 16 Ca 0.15 0.84 -0.44 0.00 -2.02 0.00 0.00 63.50 62.03 2jbf n PRO 16 Cb 0.37 -2.59 -0.01 0.00 -0.02 0.00 0.00 33.50 31.26 2jbf n PRO 16 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2jbf s LEU 17 N 0.38 5.32 0.25 2.45 1.43 0.12 -4.82 118.68 123.81 2jbf s LEU 17 Ca 0.71 -2.84 0.01 0.00 -1.03 0.00 0.00 54.13 50.99 2jbf s LEU 17 Cb -0.60 -2.36 0.31 0.00 0.03 0.00 0.00 46.19 43.56 2jbf s LEU 17 CO 0.43 -0.75 1.64 0.71 0.23 0.00 0.00 176.35 178.61 2jbf h THR 18 N 4.81 1.30 -0.02 5.49 1.35 -1.89 0.24 112.91 124.19 2jbf h THR 18 Ca 0.25 -1.53 -0.01 0.00 -0.55 0.00 0.00 66.41 64.57 2jbf h THR 18 Cb 0.92 1.58 0.00 0.00 -1.73 0.00 0.00 68.15 68.92 2jbf h THR 18 CO 1.15 0.48 -0.03 0.78 -0.25 0.00 0.00 175.52 177.65 2jbf h ASN 19 N 0.38 0.06 -0.89 5.36 4.21 -2.00 -1.98 115.58 120.72 2jbf h ASN 19 Ca 0.04 -0.58 0.08 0.00 1.21 0.00 0.00 56.30 57.05 2jbf h ASN 19 Cb 0.86 -0.02 -0.06 0.00 -1.12 0.00 0.00 38.32 37.98 2jbf h ASN 19 CO 0.07 0.62 0.57 0.25 -1.29 0.00 0.00 177.43 177.66 2jbf h LEU 20 N -0.51 0.84 -0.50 1.61 5.85 -1.94 0.24 115.31 120.90 2jbf h LEU 20 Ca 0.00 0.01 0.02 0.00 0.84 0.00 0.00 57.88 58.75 2jbf h LEU 20 Cb 0.61 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 2jbf h LEU 20 CO 0.01 0.52 0.31 -0.61 -0.34 0.00 0.00 178.44 178.33 2jbf h GLN 21 N 0.94 0.61 -0.67 1.25 4.15 -0.87 -0.30 115.11 120.21 2jbf h GLN 21 Ca 0.40 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 59.70 2jbf h GLN 21 Cb 0.31 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 27.83 2jbf h GLN 21 CO -0.16 0.40 0.11 1.96 -1.93 0.00 0.00 178.83 179.21 2jbf h GLN 22 N 0.63 1.12 -0.49 1.69 4.20 -0.24 -0.97 115.11 121.05 2jbf h GLN 22 Ca 0.20 -0.30 -0.04 0.00 0.06 0.00 0.00 58.65 58.57 2jbf h GLN 22 Cb -0.01 -0.13 -0.02 0.00 0.30 0.00 0.00 27.48 27.61 2jbf h GLN 22 CO -0.07 1.02 0.16 0.37 -0.67 0.00 0.00 178.83 179.63 2jbf h GLN 23 N 1.04 0.76 -0.36 1.46 4.15 -0.66 -1.46 115.11 120.04 2jbf h GLN 23 Ca 0.21 -0.16 -0.03 0.00 0.77 0.00 0.00 58.65 59.44 2jbf h GLN 23 Cb 0.45 -0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.01 2jbf h GLN 23 CO 0.01 0.71 0.12 0.82 -1.93 0.00 0.00 178.83 178.57 2jbf h ILE 24 N 0.66 1.20 -0.90 2.39 2.04 -0.96 -0.94 117.51 121.01 2jbf h ILE 24 Ca 0.16 -0.65 0.05 0.00 1.00 0.00 0.00 64.86 65.41 2jbf h ILE 24 Cb 0.26 0.95 -0.06 0.00 -0.74 0.00 0.00 36.82 37.24 2jbf h ILE 24 CO -0.01 0.23 0.57 -0.61 0.00 0.00 0.00 178.15 178.34 2jbf h GLN 25 N 0.44 1.05 -0.43 2.37 5.75 -1.05 -0.12 115.11 123.13 2jbf h GLN 25 Ca 0.12 -0.06 -0.08 0.00 -0.15 0.00 0.00 58.65 58.48 2jbf h GLN 25 Cb 0.23 -0.24 -0.01 0.00 1.07 0.00 0.00 27.48 28.53 2jbf h GLN 25 CO -0.01 0.70 -0.04 0.37 -2.65 0.00 0.00 178.83 177.20 2jbf h GLN 26 N 1.09 0.78 -0.15 1.69 4.15 -1.13 -0.35 115.11 121.19 2jbf h GLN 26 Ca 0.37 -0.27 0.03 0.00 0.77 0.00 0.00 58.65 59.55 2jbf h GLN 26 Cb 0.07 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 27.67 2jbf h GLN 26 CO -0.14 0.88 -0.04 1.25 -1.93 0.00 0.00 178.83 178.85 2jbf h LEU 27 N 0.61 -0.14 -0.28 -2.39 5.85 -0.25 -2.88 115.31 115.83 2jbf h LEU 27 Ca 0.12 0.05 -0.14 0.00 0.84 0.00 0.00 57.88 58.74 2jbf h LEU 27 Cb 0.55 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.67 2jbf h LEU 27 CO 0.03 -0.05 -0.37 -0.37 -0.34 0.00 0.00 178.44 177.35 2jbf h VAL 28 N 0.00 1.30 0.00 1.05 -1.51 -0.94 -3.21 116.25 112.95 2jbf h VAL 28 Ca 0.07 -1.55 0.00 0.00 -1.23 0.00 0.00 66.70 63.99 2jbf h VAL 28 Cb 0.11 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 30.91 2jbf h VAL 28 CO -0.16 0.50 0.00 -1.20 -1.23 0.00 0.00 177.57 175.48 2jbf n SER 29 N -4.20 0.02 -1.38 4.19 7.64 -0.15 -2.29 113.62 117.46 2jbf n SER 29 Ca -0.04 0.50 0.09 0.00 1.01 0.00 0.00 58.87 60.43 2jbf n SER 29 Cb 0.52 -0.51 0.32 0.00 -1.01 0.00 0.00 64.21 63.53 2jbf n SER 29 CO 0.00 0.00 0.00 -2.11 -3.01 0.00 0.00 175.04 169.92 2jbf n ARG 30 N -1.52 3.53 -3.67 1.43 1.85 -1.09 -4.87 116.66 112.31 2jbf n ARG 30 Ca 0.04 -2.78 -0.39 0.00 -1.00 0.00 0.00 57.85 53.72 2jbf n ARG 30 Cb 0.19 -1.81 -0.12 0.00 -1.05 0.00 0.00 32.46 29.67 2jbf n ARG 30 CO 0.00 0.00 0.00 -0.65 -0.01 0.00 0.00 177.63 176.97 2jbf s GLN 31 N -1.86 3.02 0.31 2.89 -1.52 -0.97 -5.07 119.66 116.47 2jbf s GLN 31 Ca 0.46 -0.93 -0.29 0.00 -1.95 0.00 0.00 55.36 52.66 2jbf s GLN 31 Cb 0.30 -3.56 -0.11 0.00 -0.22 0.00 0.00 33.01 29.43 2jbf s GLN 31 CO 0.22 -0.55 1.46 -2.14 -0.25 0.00 0.00 175.29 174.03 2jbf s PRO 32 N 1.54 4.21 0.00 2.91 0.02 -1.26 -2.93 135.00 139.49 2jbf s PRO 32 Ca 0.02 2.42 0.00 0.00 0.02 0.00 0.00 61.00 63.47 2jbf s PRO 32 Cb -0.18 -3.04 0.00 0.00 0.02 0.00 0.00 34.50 31.30 2jbf s PRO 32 CO 0.05 -0.45 0.00 0.09 -0.33 0.00 0.00 177.00 176.36 2jbf n ASN 33 N 1.43 -4.17 -4.65 2.53 3.02 -1.26 -4.98 115.26 107.18 2jbf n ASN 33 Ca 0.04 0.00 -0.35 0.00 -0.03 0.00 0.00 54.58 54.24 2jbf n ASN 33 Cb 0.40 -1.86 -0.10 0.00 -0.61 0.00 0.00 39.78 37.61 2jbf n ASN 33 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 2jbf s LEU 34 N 0.00 3.56 -0.15 3.41 1.43 -1.15 -4.11 118.68 121.66 2jbf s LEU 34 Ca 0.00 0.10 0.01 0.00 -1.03 0.00 0.00 54.13 53.21 2jbf s LEU 34 Cb 0.00 -1.83 0.02 0.00 0.03 0.00 0.00 46.19 44.41 2jbf s LEU 34 CO 0.00 0.32 -0.18 0.28 0.23 0.00 0.00 176.35 177.00 2jbf s THR 35 N -0.55 1.82 0.05 5.49 -1.32 -0.58 -4.89 115.64 115.66 2jbf s THR 35 Ca 0.09 -0.81 0.07 0.00 -1.21 0.00 0.00 61.69 59.83 2jbf s THR 35 Cb -0.12 -1.66 -0.03 0.00 -1.51 0.00 0.00 72.50 69.18 2jbf s THR 35 CO 0.02 0.50 -0.17 0.00 -2.21 0.00 0.00 174.62 172.77 2jbf s ALA 36 N 1.20 2.66 -0.00 11.08 0.00 -1.26 -0.64 121.76 134.80 2jbf s ALA 36 Ca 0.00 -1.20 0.02 0.00 0.00 0.00 0.00 51.96 50.78 2jbf s ALA 36 Cb -0.14 -0.77 -0.00 0.00 0.00 0.00 0.00 23.12 22.21 2jbf s ALA 36 CO -0.08 0.58 -0.05 0.20 0.00 0.00 0.00 175.76 176.41 2jbf s GLY 37 N -1.56 0.27 0.04 0.00 0.00 -0.38 -4.63 107.32 101.06 2jbf s GLY 37 Ca 0.16 -0.25 -0.17 0.00 0.00 0.00 0.00 44.72 44.46 2jbf s GLY 37 CO 0.06 -0.21 0.38 0.48 0.00 0.00 0.00 173.10 173.81 2jbf s LEU 38 N -0.17 0.55 -0.16 0.66 0.05 -0.12 -0.74 118.68 118.74 2jbf s LEU 38 Ca 0.02 -0.03 -0.08 0.00 0.05 0.00 0.00 54.13 54.09 2jbf s LEU 38 Cb -0.02 1.61 0.07 0.00 -2.05 0.00 0.00 46.19 45.79 2jbf s LEU 38 CO -0.00 -0.63 0.37 -0.47 -0.55 0.00 0.00 176.35 175.07 2jbf s TYR 39 N -2.38 -0.59 0.03 3.48 5.04 -0.51 -1.56 117.35 120.86 2jbf s TYR 39 Ca -0.06 1.23 0.06 0.00 -2.44 0.00 0.00 57.07 55.86 2jbf s TYR 39 Cb -0.01 0.21 -0.02 0.00 0.35 0.00 0.00 41.96 42.48 2jbf s TYR 39 CO -0.02 -0.36 -0.18 -0.06 -1.34 0.00 0.00 175.55 173.59 2jbf s PHE 40 N 1.80 1.56 -0.12 4.97 0.40 -0.35 -1.30 117.98 124.95 2jbf s PHE 40 Ca -0.06 -0.35 -0.05 0.00 -0.60 0.00 0.00 56.93 55.87 2jbf s PHE 40 Cb -0.10 -0.95 0.06 0.00 0.51 0.00 0.00 43.02 42.54 2jbf s PHE 40 CO -0.12 0.05 0.24 0.12 0.70 0.00 0.00 175.22 176.21 2jbf s PHE 41 N -0.72 -0.36 -0.42 0.36 2.19 -0.66 -1.35 117.98 117.02 2jbf s PHE 41 Ca 0.05 0.87 -0.25 0.00 0.33 0.00 0.00 56.93 57.94 2jbf s PHE 41 Cb -0.08 -0.05 0.02 0.00 -1.31 0.00 0.00 43.02 41.60 2jbf s PHE 41 CO 0.01 -0.31 0.89 1.21 1.83 0.00 0.00 175.22 178.85 2jbf s ASN 42 N 2.11 6.56 0.57 6.13 3.84 0.73 -1.08 114.94 133.80 2jbf s ASN 42 Ca -0.01 0.29 0.34 0.00 0.21 0.00 0.00 52.86 53.68 2jbf s ASN 42 Cb -0.12 -2.44 1.67 0.00 -0.55 0.00 0.00 41.25 39.81 2jbf s ASN 42 CO -0.08 -0.93 2.12 -0.07 -2.79 0.00 0.00 177.10 175.35 2jbf h LEU 43 N 10.25 0.00 0.06 3.21 4.07 -1.43 -0.02 115.31 131.44 2jbf h LEU 43 Ca -0.24 0.00 -0.30 0.00 0.08 0.00 0.00 57.88 57.42 2jbf h LEU 43 Cb 1.08 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.79 2jbf h LEU 43 CO 0.99 0.05 -1.63 0.47 -1.08 0.00 0.00 178.44 177.25 2jbf n ASP 44 N -3.31 1.98 0.03 -0.43 8.00 -1.25 -4.37 116.55 117.20 2jbf n ASP 44 Ca -0.01 0.32 0.11 0.00 0.71 0.00 0.00 54.79 55.92 2jbf n ASP 44 Cb 0.22 -0.92 -0.10 0.00 -0.02 0.00 0.00 41.12 40.31 2jbf n ASP 44 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2jbf n SER 45 N -4.00 0.35 0.00 -2.24 3.41 -1.19 -4.79 113.62 105.16 2jbf n SER 45 Ca -0.33 0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.32 2jbf n SER 45 Cb 0.85 1.39 0.00 0.00 -0.26 0.00 0.00 64.21 66.19 2jbf n SER 45 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2jbf n GLY 46 N 1.26 1.87 3.76 5.00 0.00 -0.03 -4.76 105.19 112.30 2jbf n GLY 46 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2jbf n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbf s ALA 47 N -3.20 3.62 0.04 4.61 0.00 -1.25 -0.82 121.76 124.75 2jbf s ALA 47 Ca 0.00 1.47 0.01 0.00 0.00 0.00 0.00 51.96 53.44 2jbf s ALA 47 Cb 0.00 -3.59 -0.03 0.00 0.00 0.00 0.00 23.12 19.51 2jbf s ALA 47 CO 0.00 -0.90 -0.06 -1.54 0.00 0.00 0.00 175.76 173.26 2jbf s SER 48 N 0.06 0.69 -0.02 0.00 1.04 -0.84 -0.19 113.70 114.44 2jbf s SER 48 Ca 0.56 -0.65 0.01 0.00 0.48 0.00 0.00 55.95 56.36 2jbf s SER 48 Cb -0.45 0.08 0.01 0.00 0.10 0.00 0.00 66.02 65.76 2jbf s SER 48 CO 0.53 -0.31 -0.04 -0.76 0.98 0.00 0.00 173.24 173.64 2jbf s LEU 49 N -1.89 1.73 -0.21 2.42 1.43 -0.46 -0.70 118.68 121.01 2jbf s LEU 49 Ca -0.07 -0.10 -0.05 0.00 -1.03 0.00 0.00 54.13 52.89 2jbf s LEU 49 Cb -0.06 -0.31 0.07 0.00 0.03 0.00 0.00 46.19 45.92 2jbf s LEU 49 CO -0.02 0.02 0.10 0.21 0.23 0.00 0.00 176.35 176.89 2jbf s ASN 50 N 0.27 2.77 -0.38 2.29 3.84 -1.26 -1.21 114.94 121.25 2jbf s ASN 50 Ca -0.03 -0.85 0.02 0.00 0.21 0.00 0.00 52.86 52.21 2jbf s ASN 50 Cb -0.07 -0.28 0.11 0.00 -0.55 0.00 0.00 41.25 40.46 2jbf s ASN 50 CO -0.00 -0.38 0.14 -0.69 -2.79 0.00 0.00 177.10 173.38 2jbf s VAL 51 N 2.12 1.70 -1.84 -5.21 1.01 -0.60 -4.73 120.40 112.85 2jbf s VAL 51 Ca 0.04 -2.28 0.00 0.00 0.00 0.00 0.00 61.98 59.75 2jbf s VAL 51 Cb -0.16 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 33.99 2jbf s VAL 51 CO -0.19 -0.73 0.00 0.61 0.00 0.00 0.00 175.10 174.79 2jbf n GLY 52 N 4.07 1.21 0.28 4.51 0.00 -1.26 -0.95 105.19 113.04 2jbf n GLY 52 Ca 0.04 -0.13 0.15 0.00 0.00 0.00 0.00 46.02 46.07 2jbf n GLY 52 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2jbf h GLY 53 N 0.00 0.00 0.83 -0.02 0.00 -1.81 -2.73 103.07 99.34 2jbf h GLY 53 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.94 2jbf h GLY 53 CO 0.54 0.00 -0.15 1.22 0.00 0.00 0.00 176.54 178.15 2jbf n ASP 54 N -3.54 0.56 -4.81 0.19 8.00 -1.26 -0.29 116.55 115.40 2jbf n ASP 54 Ca -0.02 -0.56 -0.33 0.00 0.71 0.00 0.00 54.79 54.59 2jbf n ASP 54 Cb 0.20 -0.04 -0.06 0.00 -0.02 0.00 0.00 41.12 41.20 2jbf n ASP 54 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2jbf s GLN 55 N -2.54 4.18 0.02 -1.24 -2.07 -1.03 -4.95 119.66 112.04 2jbf s GLN 55 Ca 0.26 1.17 -0.19 0.00 -1.82 0.00 0.00 55.36 54.79 2jbf s GLN 55 Cb 0.20 -2.21 -0.06 0.00 -1.09 0.00 0.00 33.01 29.85 2jbf s GLN 55 CO 0.50 -0.07 0.55 0.54 -1.32 0.00 0.00 175.29 175.48 2jbf s VAL 56 N -2.11 4.87 0.12 3.63 0.11 -1.26 -4.27 120.40 121.48 2jbf s VAL 56 Ca 0.62 1.15 0.04 0.00 -2.93 0.00 0.00 61.98 60.87 2jbf s VAL 56 Cb -0.11 -3.88 -0.04 0.00 -1.53 0.00 0.00 36.38 30.83 2jbf s VAL 56 CO 0.15 0.50 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.95 2jbf s PHE 57 N -0.68 1.17 0.25 1.54 0.40 0.10 -4.99 117.98 115.76 2jbf s PHE 57 Ca 0.29 -0.69 -0.31 0.00 -0.60 0.00 0.00 56.93 55.62 2jbf s PHE 57 Cb -0.18 -0.62 -0.13 0.00 0.51 0.00 0.00 43.02 42.60 2jbf s PHE 57 CO 0.17 0.04 1.48 -2.30 0.70 0.00 0.00 175.22 175.31 2jbf n PRO 58 N 0.27 2.24 0.11 0.24 -0.02 -1.26 -1.31 135.00 135.27 2jbf n PRO 58 Ca -0.14 0.80 -0.01 0.00 -2.02 0.00 0.00 63.50 62.13 2jbf n PRO 58 Cb 0.59 -2.50 0.01 0.00 -0.02 0.00 0.00 33.50 31.58 2jbf n PRO 58 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2jbf h ALA 59 N 4.56 0.60 -0.53 3.55 0.00 -0.85 -3.44 119.26 123.15 2jbf h ALA 59 Ca -0.45 -0.63 0.00 0.00 0.00 0.00 0.00 54.91 53.83 2jbf h ALA 59 Cb 1.26 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.94 2jbf h ALA 59 CO 0.78 0.87 0.00 0.00 0.00 0.00 0.00 179.25 180.90 2jbf n ALA 60 N -2.29 0.00 1.11 0.00 0.00 -1.26 -2.03 120.51 116.03 2jbf n ALA 60 Ca 0.01 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.56 2jbf n ALA 60 Cb 0.78 0.00 0.57 0.00 0.00 0.00 0.00 19.45 20.81 2jbf n ALA 60 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2jbf n SER 61 N -2.07 0.00 0.29 0.00 7.64 -1.26 -3.10 113.62 115.12 2jbf n SER 61 Ca 0.00 -0.17 0.14 0.00 1.01 0.00 0.00 58.87 59.85 2jbf n SER 61 Cb 0.00 -0.22 0.87 0.00 -1.01 0.00 0.00 64.21 63.85 2jbf n SER 61 CO 0.00 0.00 0.00 0.71 -3.01 0.00 0.00 175.04 172.74 2jbf h THR 62 N 0.00 0.60 0.00 0.44 1.35 -1.48 -2.00 112.91 111.82 2jbf h THR 62 Ca 0.00 -0.03 0.00 0.00 -0.55 0.00 0.00 66.41 65.83 2jbf h THR 62 Cb 0.16 1.02 0.00 0.00 -1.73 0.00 0.00 68.15 67.60 2jbf h THR 62 CO 0.00 0.01 0.00 -0.29 -0.25 0.00 0.00 175.52 174.99 2jbf h ILE 63 N 0.00 0.00 0.00 6.82 6.09 -1.71 -1.66 117.51 127.05 2jbf h ILE 63 Ca -0.00 -0.20 -0.02 0.00 -1.37 0.00 0.00 64.86 63.27 2jbf h ILE 63 Cb 0.02 1.08 -0.00 0.00 0.47 0.00 0.00 36.82 38.39 2jbf h ILE 63 CO 0.00 0.00 -0.12 0.11 -3.07 0.00 0.00 178.15 175.08 2jbf h LYS 64 N 0.00 0.00 0.72 2.19 1.57 -1.62 -2.65 116.57 116.78 2jbf h LYS 64 Ca 0.00 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.74 2jbf h LYS 64 Cb 0.21 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.53 2jbf h LYS 64 CO 0.00 0.12 -0.35 0.35 -0.57 0.00 0.00 179.45 179.00 2jbf h PHE 65 N 0.00 -0.89 -0.90 -1.35 3.57 -1.50 -0.40 116.94 115.47 2jbf h PHE 65 Ca -0.00 -0.02 0.18 0.00 3.53 0.00 0.00 57.97 61.66 2jbf h PHE 65 Cb 0.31 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 39.27 2jbf h PHE 65 CO 0.00 -0.55 0.59 -1.35 -2.23 0.00 0.00 178.31 174.77 2jbf h PRO 66 N -1.23 0.51 -0.43 6.41 0.11 -1.72 -1.03 132.00 134.63 2jbf h PRO 66 Ca -0.10 -0.03 -0.02 0.00 0.11 0.00 0.00 66.00 65.96 2jbf h PRO 66 Cb 0.75 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.73 2jbf h PRO 66 CO 0.16 0.34 0.18 0.82 -0.21 0.00 0.00 178.00 179.30 2jbf h ILE 67 N 0.53 1.19 -0.97 4.15 2.04 -1.40 -1.62 117.51 121.43 2jbf h ILE 67 Ca 0.47 -0.58 0.04 0.00 1.00 0.00 0.00 64.86 65.79 2jbf h ILE 67 Cb 0.99 0.78 -0.06 0.00 -0.74 0.00 0.00 36.82 37.79 2jbf h ILE 67 CO -0.20 0.22 0.64 0.25 0.00 0.00 0.00 178.15 179.05 2jbf h LEU 68 N 0.55 1.06 -0.59 1.44 5.85 0.19 -1.16 115.31 122.65 2jbf h LEU 68 Ca 0.14 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 58.83 2jbf h LEU 68 Cb 0.17 -0.24 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 2jbf h LEU 68 CO -0.01 0.73 0.26 0.58 -0.34 0.00 0.00 178.44 179.66 2jbf h VAL 69 N 1.23 1.22 -0.16 1.05 2.07 -1.07 -1.84 116.25 118.75 2jbf h VAL 69 Ca 0.39 -0.65 -0.09 0.00 0.82 0.00 0.00 66.70 67.17 2jbf h VAL 69 Cb 0.00 0.55 -0.01 0.00 -1.52 0.00 0.00 31.29 30.31 2jbf h VAL 69 CO -0.12 0.26 -0.28 0.00 0.02 0.00 0.00 177.57 177.45 2jbf h ALA 70 N 1.10 1.23 0.44 1.67 0.00 -0.56 -0.82 119.26 122.33 2jbf h ALA 70 Ca 0.20 -0.33 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 2jbf h ALA 70 Cb 0.16 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 2jbf h ALA 70 CO -0.02 0.51 -0.25 0.35 0.00 0.00 0.00 179.25 179.85 2jbf h PHE 71 N 0.27 -0.64 -0.04 0.00 3.57 -0.80 -1.99 116.94 117.31 2jbf h PHE 71 Ca 0.04 -0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.43 2jbf h PHE 71 Cb 0.64 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.59 2jbf h PHE 71 CO 0.01 -0.39 -0.43 0.74 -2.23 0.00 0.00 178.31 176.02 2jbf h PHE 72 N -0.64 0.11 -0.61 0.41 0.04 -1.09 -1.70 116.94 113.44 2jbf h PHE 72 Ca -0.05 -0.03 0.05 0.00 2.80 0.00 0.00 57.97 60.73 2jbf h PHE 72 Cb 0.51 -0.02 -0.05 0.00 2.20 0.00 0.00 35.95 38.59 2jbf h PHE 72 CO -0.07 0.50 0.35 -0.22 -0.60 0.00 0.00 178.31 178.27 2jbf h LYS 73 N 0.08 0.64 -0.80 1.51 3.64 -1.09 -0.20 116.57 120.35 2jbf h LYS 73 Ca 0.00 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.31 2jbf h LYS 73 Cb 0.79 -0.14 -0.04 0.00 -0.41 0.00 0.00 32.23 32.43 2jbf h LYS 73 CO 0.06 0.42 0.34 0.00 -2.27 0.00 0.00 179.45 178.00 2jbf h ALA 74 N 1.30 1.09 -0.33 5.00 0.00 -0.75 -1.15 119.26 124.43 2jbf h ALA 74 Ca 0.26 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2jbf h ALA 74 Cb 0.12 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 2jbf h ALA 74 CO -0.15 0.66 0.22 0.28 0.00 0.00 0.00 179.25 180.25 2jbf h VAL 75 N 1.15 1.08 -0.93 0.00 2.07 -0.98 0.46 116.25 119.11 2jbf h VAL 75 Ca 0.27 -0.15 -0.00 0.00 0.82 0.00 0.00 66.70 67.63 2jbf h VAL 75 Cb 0.18 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.50 2jbf h VAL 75 CO -0.03 0.08 0.57 0.44 0.02 0.00 0.00 177.57 178.65 2jbf h ASP 76 N 0.44 1.10 0.21 0.57 3.32 -0.58 -1.94 116.42 119.55 2jbf h ASP 76 Ca 0.12 -0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.11 2jbf h ASP 76 Cb -0.04 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.23 2jbf h ASP 76 CO -0.03 0.84 -0.02 -0.62 -1.72 0.00 0.00 179.24 177.69 2jbf n GLU 77 N -4.36 0.86 -1.02 3.56 1.02 -0.47 -4.91 120.64 115.31 2jbf n GLU 77 Ca 0.10 -0.12 -0.01 0.00 -0.02 0.00 0.00 57.16 57.12 2jbf n GLU 77 Cb 0.05 -1.50 -0.00 0.00 -0.02 0.00 0.00 31.44 29.97 2jbf n GLU 77 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2jbf n GLY 78 N 1.14 0.47 0.10 0.62 0.00 -0.72 -4.91 105.19 101.89 2jbf n GLY 78 Ca 0.19 -0.52 0.05 0.00 0.00 0.00 0.00 46.02 45.74 2jbf n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2jbf n ARG 79 N -2.87 0.62 -4.24 1.61 1.74 0.07 -4.83 116.66 108.76 2jbf n ARG 79 Ca -0.01 0.18 -0.18 0.00 -0.77 0.00 0.00 57.85 57.07 2jbf n ARG 79 Cb 0.04 -1.81 -0.13 0.00 -1.02 0.00 0.00 32.46 29.54 2jbf n ARG 79 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 2jbf s VAL 80 N -3.11 0.91 0.27 1.55 -7.23 -1.07 -4.98 120.40 106.74 2jbf s VAL 80 Ca -0.02 -0.99 0.09 0.00 -1.81 0.00 0.00 61.98 59.25 2jbf s VAL 80 Cb 0.09 -0.86 -0.04 0.00 0.56 0.00 0.00 36.38 36.12 2jbf s VAL 80 CO 0.80 -0.11 0.03 0.42 -0.31 0.00 0.00 175.10 175.93 2jbf s THR 81 N -0.97 3.54 0.28 5.32 -4.23 -1.26 -3.98 115.64 114.33 2jbf s THR 81 Ca -0.02 -1.84 0.07 0.00 -1.18 0.00 0.00 61.69 58.72 2jbf s THR 81 Cb -0.08 -2.92 0.01 0.00 1.34 0.00 0.00 72.50 70.85 2jbf s THR 81 CO 0.01 -0.36 1.65 -0.07 -0.54 0.00 0.00 174.62 175.31 2jbf h LEU 82 N 1.82 0.20 -1.56 4.79 3.38 -1.97 -3.26 115.31 118.71 2jbf h LEU 82 Ca -0.45 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.43 2jbf h LEU 82 Cb 1.25 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.94 2jbf h LEU 82 CO 0.61 0.67 -0.14 0.00 0.09 0.00 0.00 178.44 179.66 2jbf n GLN 83 N -3.95 1.93 -2.16 1.13 3.00 -1.26 -1.65 117.38 114.41 2jbf n GLN 83 Ca -0.02 -1.56 -0.36 0.00 -0.01 0.00 0.00 57.00 55.06 2jbf n GLN 83 Cb 0.54 -1.47 0.01 0.00 0.00 0.00 0.00 30.24 29.32 2jbf n GLN 83 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.06 175.23 2jbf s GLU 84 N -2.15 3.28 -0.21 -1.09 -1.05 -1.23 -4.56 118.70 111.69 2jbf s GLU 84 Ca 0.26 1.73 -0.22 0.00 -0.15 0.00 0.00 54.97 56.59 2jbf s GLU 84 Cb 0.20 -2.05 -0.02 0.00 -0.44 0.00 0.00 34.13 31.82 2jbf s GLU 84 CO 0.38 -0.94 0.70 1.03 0.95 0.00 0.00 175.26 177.39 2jbf s ARG 85 N -3.20 4.20 -0.13 -4.83 1.81 -1.26 -1.13 118.95 114.41 2jbf s ARG 85 Ca 0.73 0.73 -0.08 0.00 -1.72 0.00 0.00 55.73 55.39 2jbf s ARG 85 Cb -0.27 -3.61 -0.04 0.00 -0.45 0.00 0.00 34.95 30.58 2jbf s ARG 85 CO 0.31 -0.34 0.15 -0.51 -0.68 0.00 0.00 175.30 174.23 2jbf s LEU 86 N 2.25 4.37 -0.15 2.53 1.43 0.30 -4.88 118.68 124.52 2jbf s LEU 86 Ca 0.31 0.46 -0.12 0.00 -1.03 0.00 0.00 54.13 53.75 2jbf s LEU 86 Cb -0.16 -2.10 -0.05 0.00 0.03 0.00 0.00 46.19 43.92 2jbf s LEU 86 CO 0.10 0.37 0.23 -0.89 0.23 0.00 0.00 176.35 176.38 2jbf s THR 87 N -0.82 5.35 -1.28 5.49 2.01 -1.26 -1.38 115.64 123.75 2jbf s THR 87 Ca 0.14 0.40 -0.17 0.00 0.31 0.00 0.00 61.69 62.38 2jbf s THR 87 Cb -0.12 -3.55 0.10 0.00 0.01 0.00 0.00 72.50 68.94 2jbf s THR 87 CO 0.04 0.46 1.66 0.80 -0.69 0.00 0.00 174.62 176.88 2jbf n MET 88 N 3.17 3.25 -2.20 4.92 1.56 0.35 -4.97 117.12 123.20 2jbf n MET 88 Ca -0.15 -3.45 -0.35 0.00 -0.27 0.00 0.00 57.70 53.49 2jbf n MET 88 Cb 0.52 -3.35 0.01 0.00 2.15 0.00 0.00 33.22 32.55 2jbf n MET 88 CO 0.00 0.00 0.00 1.03 -0.73 0.00 0.00 175.97 176.27 2jbf s ARG 89 N 3.38 3.26 0.39 2.12 0.52 -1.26 -0.22 118.95 127.14 2jbf s ARG 89 Ca 0.50 1.67 0.15 0.00 -0.52 0.00 0.00 55.73 57.53 2jbf s ARG 89 Cb 0.02 -1.99 1.02 0.00 0.52 0.00 0.00 34.95 34.52 2jbf s ARG 89 CO 0.05 -0.93 1.81 -1.35 0.02 0.00 0.00 175.30 174.90 2jbf h PRO 90 N 1.12 0.46 0.00 3.54 0.11 -1.95 -1.59 132.00 133.70 2jbf h PRO 90 Ca -0.50 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.58 2jbf h PRO 90 Cb 1.27 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.28 2jbf h PRO 90 CO 0.56 0.31 0.00 -0.40 -0.21 0.00 0.00 178.00 178.26 2jbf n ASP 91 N -4.59 0.31 -0.00 -2.05 5.75 -1.26 -2.70 116.55 112.01 2jbf n ASP 91 Ca 0.22 0.58 0.09 0.00 -0.01 0.00 0.00 54.79 55.66 2jbf n ASP 91 Cb 0.72 -0.64 -0.12 0.00 -1.03 0.00 0.00 41.12 40.06 2jbf n ASP 91 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 2jbf n LEU 92 N -1.85 0.59 -4.73 -2.12 4.77 -0.60 -4.98 117.00 108.08 2jbf n LEU 92 Ca 0.03 -0.35 -0.41 0.00 -0.03 0.00 0.00 56.01 55.25 2jbf n LEU 92 Cb 0.20 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.26 2jbf n LEU 92 CO 0.16 0.15 0.98 -0.63 -1.33 0.00 0.00 177.39 176.72 2jbf s ILE 93 N -2.89 3.34 0.02 -0.08 1.01 -1.10 -4.49 121.20 117.02 2jbf s ILE 93 Ca 0.03 1.07 0.01 0.00 0.00 0.00 0.00 60.65 61.76 2jbf s ILE 93 Cb 0.13 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.90 2jbf s ILE 93 CO 0.75 0.14 -0.05 0.00 0.00 0.00 0.00 174.94 175.78 2jbf s ALA 94 N 0.33 0.36 0.81 9.38 0.00 -1.26 -4.96 121.76 126.41 2jbf s ALA 94 Ca 0.58 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.03 2jbf s ALA 94 Cb -0.35 0.03 0.00 0.00 0.00 0.00 0.00 23.12 22.79 2jbf s ALA 94 CO 0.36 -0.02 0.00 -0.35 0.00 0.00 0.00 175.76 175.75 2jbf n PRO 95 N 2.03 0.95 0.00 0.00 -0.04 -1.26 -4.29 135.00 132.40 2jbf n PRO 95 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 2jbf n PRO 95 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 2jbf n PRO 95 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2jbf n GLU 96 N -0.36 0.00 -1.60 0.54 -0.58 -1.26 -4.65 120.64 112.72 2jbf n GLU 96 Ca 0.00 0.00 -0.47 0.00 -0.42 0.00 0.00 57.16 56.27 2jbf n GLU 96 Cb 0.00 0.00 -0.03 0.00 -0.57 0.00 0.00 31.44 30.84 2jbf n GLU 96 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2jbf n ALA 97 N 5.63 -0.21 0.00 0.62 0.00 -1.26 -4.88 120.51 120.40 2jbf n ALA 97 Ca 0.00 0.44 0.00 0.00 0.00 0.00 0.00 53.44 53.88 2jbf n ALA 97 Cb 0.00 -2.09 0.00 0.00 0.00 0.00 0.00 19.45 17.36 2jbf n ALA 97 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jbf n GLY 98 N 1.88 3.97 0.02 0.00 0.00 -1.26 -1.60 105.19 108.21 2jbf n GLY 98 Ca 0.13 -1.56 0.05 0.00 0.00 0.00 0.00 46.02 44.64 2jbf n GLY 98 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2jbf n THR 99 N -1.49 0.22 -0.20 2.61 -2.24 -1.26 -4.55 114.28 107.38 2jbf n THR 99 Ca 0.00 -0.42 0.04 0.00 -2.27 0.00 0.00 64.05 61.40 2jbf n THR 99 Cb 0.00 -0.03 0.31 0.00 -2.10 0.00 0.00 70.33 68.51 2jbf n THR 99 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 2jbf h LEU 100 N 0.00 0.74 -2.44 3.22 3.38 -1.96 -1.88 115.31 116.37 2jbf h LEU 100 Ca -0.09 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.88 2jbf h LEU 100 Cb 0.99 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.57 2jbf h LEU 100 CO 0.00 0.50 0.17 0.06 0.09 0.00 0.00 178.44 179.26 2jbf h GLN 101 N 0.85 0.00 -0.22 1.13 3.07 -1.85 -0.50 115.11 117.59 2jbf h GLN 101 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.05 2jbf h GLN 101 Cb 0.14 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.70 2jbf h GLN 101 CO -0.10 0.00 0.00 0.66 0.09 0.00 0.00 178.83 179.48 2jbf n TYR 102 N -2.95 0.27 -2.24 0.06 4.01 -0.71 -4.92 117.16 110.69 2jbf n TYR 102 Ca -0.02 -0.13 -0.25 0.00 -0.16 0.00 0.00 57.90 57.33 2jbf n TYR 102 Cb 0.22 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.33 2jbf n TYR 102 CO 0.00 0.00 0.00 -0.65 -0.46 0.00 0.00 176.86 175.75 2jbf s GLN 103 N -1.73 2.13 0.18 -0.72 -1.52 -0.20 -5.03 119.66 112.76 2jbf s GLN 103 Ca 0.34 -0.34 -0.31 0.00 -1.95 0.00 0.00 55.36 53.11 2jbf s GLN 103 Cb 0.21 -2.19 -0.09 0.00 -0.22 0.00 0.00 33.01 30.73 2jbf s GLN 103 CO 0.31 -1.26 1.38 0.21 -0.25 0.00 0.00 175.29 175.68 2jbf s LYS 104 N -5.24 4.33 0.24 2.91 2.20 -1.26 -4.96 119.74 117.97 2jbf s LYS 104 Ca 0.61 2.14 -0.30 0.00 -0.36 0.00 0.00 55.97 58.06 2jbf s LYS 104 Cb -0.10 -3.19 -0.14 0.00 -1.51 0.00 0.00 37.83 32.89 2jbf s LYS 104 CO 0.45 -0.38 1.14 -2.30 -0.36 0.00 0.00 175.35 173.90 2jbf n PRO 105 N 3.07 1.43 -1.06 4.03 -0.02 -1.26 -1.92 135.00 139.27 2jbf n PRO 105 Ca 0.09 0.51 -0.02 0.00 -2.02 0.00 0.00 63.50 62.05 2jbf n PRO 105 Cb 0.42 -1.97 -0.01 0.00 -0.02 0.00 0.00 33.50 31.91 2jbf n PRO 105 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 2jbf n ASN 106 N 1.63 -4.56 -4.73 2.55 3.02 0.69 -5.02 115.26 108.83 2jbf n ASN 106 Ca 0.12 0.05 -0.33 0.00 -0.03 0.00 0.00 54.58 54.38 2jbf n ASN 106 Cb 0.29 -2.25 0.09 0.00 -0.61 0.00 0.00 39.78 37.30 2jbf n ASN 106 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2jbf s SER 107 N -2.16 4.37 0.24 6.41 1.04 -0.81 -4.55 113.70 118.23 2jbf s SER 107 Ca 0.00 2.21 0.11 0.00 0.48 0.00 0.00 55.95 58.75 2jbf s SER 107 Cb 0.00 -2.57 -0.05 0.00 0.10 0.00 0.00 66.02 63.50 2jbf s SER 107 CO 0.00 -2.14 -0.21 -1.10 0.98 0.00 0.00 173.24 170.78 2jbf s GLN 108 N -4.08 1.56 -0.03 4.02 -0.21 -1.26 -0.49 119.66 119.17 2jbf s GLN 108 Ca 0.71 -1.65 -0.11 0.00 0.02 0.00 0.00 55.36 54.33 2jbf s GLN 108 Cb -0.25 -1.69 0.02 0.00 1.00 0.00 0.00 33.01 32.08 2jbf s GLN 108 CO 0.46 0.33 0.24 0.71 -2.12 0.00 0.00 175.29 174.91 2jbf s TYR 109 N -2.26 -0.14 0.43 0.91 1.51 -0.48 -4.95 117.35 112.38 2jbf s TYR 109 Ca 0.25 0.25 -0.26 0.00 -1.01 0.00 0.00 57.07 56.30 2jbf s TYR 109 Cb -0.06 0.05 -0.09 0.00 -0.11 0.00 0.00 41.96 41.75 2jbf s TYR 109 CO 0.12 -0.30 1.41 0.00 -1.11 0.00 0.00 175.55 175.67 2jbf n ALA 110 N 1.74 1.93 -0.25 3.71 0.00 -1.26 -0.54 120.51 125.83 2jbf n ALA 110 Ca -0.20 0.27 -0.04 0.00 0.00 0.00 0.00 53.44 53.47 2jbf n ALA 110 Cb 0.56 -2.37 0.07 0.00 0.00 0.00 0.00 19.45 17.71 2jbf n ALA 110 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2jbf h ALA 111 N 2.35 0.92 -0.74 0.00 0.00 -0.89 -2.25 119.26 118.66 2jbf h ALA 111 Ca -0.50 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.35 2jbf h ALA 111 Cb 1.27 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 18.77 2jbf h ALA 111 CO 0.61 0.26 0.36 1.25 0.00 0.00 0.00 179.25 181.74 2jbf h LEU 112 N 0.91 0.96 -0.97 0.00 5.85 -1.59 -0.60 115.31 119.86 2jbf h LEU 112 Ca 0.27 -0.13 0.03 0.00 0.84 0.00 0.00 57.88 58.90 2jbf h LEU 112 Cb -0.03 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 40.70 2jbf h LEU 112 CO -0.09 0.82 0.64 -0.08 -0.34 0.00 0.00 178.44 179.39 2jbf h GLU 113 N 1.03 1.21 -0.10 1.25 4.81 -1.69 0.75 114.58 121.85 2jbf h GLU 113 Ca 0.25 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.38 2jbf h GLU 113 Cb 0.10 -0.27 -0.00 0.00 0.63 0.00 0.00 28.75 29.21 2jbf h GLU 113 CO -0.03 0.80 -0.06 0.28 -0.73 0.00 0.00 179.01 179.27 2jbf h VAL 114 N 1.25 1.33 -0.80 0.32 2.07 -1.08 -1.96 116.25 117.38 2jbf h VAL 114 Ca 0.38 -1.12 0.02 0.00 0.82 0.00 0.00 66.70 66.80 2jbf h VAL 114 Cb -0.04 1.87 -0.04 0.00 -1.52 0.00 0.00 31.29 31.56 2jbf h VAL 114 CO -0.11 0.32 0.53 0.00 0.02 0.00 0.00 177.57 178.32 2jbf h ALA 115 N 0.62 1.48 -0.11 1.67 0.00 -0.72 -1.95 119.26 120.25 2jbf h ALA 115 Ca 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.87 2jbf h ALA 115 Cb 0.53 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 2jbf h ALA 115 CO 0.02 0.46 0.02 0.93 0.00 0.00 0.00 179.25 180.68 2jbf h GLU 116 N 1.03 0.17 -0.61 0.00 5.08 -0.70 -3.04 114.58 116.52 2jbf h GLU 116 Ca 0.31 -0.04 -0.02 0.00 -1.00 0.00 0.00 59.36 58.60 2jbf h GLU 116 Cb -0.03 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 2jbf h GLU 116 CO -0.08 0.36 0.30 -0.07 -1.00 0.00 0.00 179.01 178.52 2jbf h LEU 117 N -0.04 0.76 -1.07 1.33 3.38 -1.08 0.12 115.31 118.71 2jbf h LEU 117 Ca 0.03 -0.07 0.22 0.00 0.09 0.00 0.00 57.88 58.15 2jbf h LEU 117 Cb 0.27 -0.19 -0.11 0.00 0.09 0.00 0.00 40.66 40.71 2jbf h LEU 117 CO 0.00 0.64 0.61 -0.03 0.09 0.00 0.00 178.44 179.75 2jbf h MET 118 N 0.85 0.63 0.00 1.13 4.05 -1.25 -1.49 114.93 118.86 2jbf h MET 118 Ca 0.21 -0.04 -0.29 0.00 -0.28 0.00 0.00 59.70 59.30 2jbf h MET 118 Cb 0.07 -0.14 -0.04 0.00 -0.80 0.00 0.00 31.60 30.69 2jbf h MET 118 CO -0.03 0.42 -1.69 -0.89 0.23 0.00 0.00 176.91 174.95 2jbf n ILE 119 N -4.77 1.52 -0.07 1.77 2.08 -0.40 -2.91 119.36 116.57 2jbf n ILE 119 Ca 0.24 -0.14 -0.09 0.00 0.56 0.00 0.00 62.75 63.32 2jbf n ILE 119 Cb 0.66 -2.02 -0.02 0.00 -0.75 0.00 0.00 39.64 37.51 2jbf n ILE 119 CO 0.00 0.00 0.00 0.71 0.56 0.00 0.00 176.55 177.82 2jbf h THR 120 N -1.00 1.09 -0.10 1.39 1.35 -0.88 -3.19 112.91 111.58 2jbf h THR 120 Ca -0.44 -0.21 0.00 0.00 -0.55 0.00 0.00 66.41 65.21 2jbf h THR 120 Cb 1.35 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.51 2jbf h THR 120 CO -0.27 0.09 0.00 2.30 -0.25 0.00 0.00 175.52 177.39 2jbf n ILE 121 N -4.87 1.23 -2.57 6.82 -5.35 -1.12 -1.37 119.36 112.12 2jbf n ILE 121 Ca -0.02 -1.27 -0.17 0.00 -0.27 0.00 0.00 62.75 61.02 2jbf n ILE 121 Cb 0.05 0.33 0.01 0.00 -1.74 0.00 0.00 39.64 38.28 2jbf n ILE 121 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2jbf n SER 122 N -0.43 -5.07 -4.64 7.28 2.88 -1.05 -4.21 113.62 108.39 2jbf n SER 122 Ca 0.07 -0.11 -0.42 0.00 -1.33 0.00 0.00 58.87 57.07 2jbf n SER 122 Cb 0.40 -4.05 -0.03 0.00 -0.75 0.00 0.00 64.21 59.78 2jbf n SER 122 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2jbf s ASP 123 N -2.49 6.05 0.10 -3.46 -1.08 -0.58 -4.58 116.67 110.64 2jbf s ASP 123 Ca 0.11 2.36 -0.13 0.00 -0.52 0.00 0.00 52.55 54.37 2jbf s ASP 123 Cb -0.05 -2.52 -0.14 0.00 -1.46 0.00 0.00 42.92 38.75 2jbf s ASP 123 CO 0.14 -1.42 1.33 0.78 0.52 0.00 0.00 175.17 176.52 2jbf h ASN 124 N 12.38 0.91 -0.40 -0.34 2.35 -1.56 -1.01 115.58 127.91 2jbf h ASN 124 Ca -0.46 -0.60 0.06 0.00 -0.55 0.00 0.00 56.30 54.75 2jbf h ASN 124 Cb 1.24 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 39.29 2jbf h ASN 124 CO 0.95 1.36 0.11 0.74 -1.65 0.00 0.00 177.43 178.93 2jbf h THR 125 N 0.52 0.83 -0.55 2.81 2.02 -1.79 -1.29 112.91 115.47 2jbf h THR 125 Ca -0.03 -0.08 0.04 0.00 0.77 0.00 0.00 66.41 67.10 2jbf h THR 125 Cb 1.29 0.56 -0.04 0.00 -1.74 0.00 0.00 68.15 68.22 2jbf h THR 125 CO 0.14 0.05 0.31 0.00 0.37 0.00 0.00 175.52 176.38 2jbf h ALA 126 N 1.28 0.71 -0.35 6.16 0.00 -1.81 -0.80 119.26 124.45 2jbf h ALA 126 Ca 0.19 0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.14 2jbf h ALA 126 Cb 0.21 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 2jbf h ALA 126 CO -0.23 -0.01 0.15 1.15 0.00 0.00 0.00 179.25 180.32 2jbf h THR 127 N 0.59 0.95 -0.52 0.00 2.02 -0.74 -1.14 112.91 114.06 2jbf h THR 127 Ca 0.23 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.28 2jbf h THR 127 Cb 0.09 0.60 -0.03 0.00 -1.74 0.00 0.00 68.15 67.08 2jbf h THR 127 CO -0.13 0.06 0.24 0.78 0.37 0.00 0.00 175.52 176.84 2jbf h ASN 128 N 0.32 0.66 -0.69 4.18 2.35 -0.53 -0.81 115.58 121.07 2jbf h ASN 128 Ca 0.15 -0.06 -0.05 0.00 -0.55 0.00 0.00 56.30 55.79 2jbf h ASN 128 Cb 0.09 -0.17 -0.03 0.00 0.05 0.00 0.00 38.32 38.26 2jbf h ASN 128 CO -0.12 0.58 0.24 0.24 -1.65 0.00 0.00 177.43 176.71 2jbf h MET 129 N 0.74 1.05 -0.17 0.81 2.86 -0.50 -1.25 114.93 118.47 2jbf h MET 129 Ca 0.18 -0.21 -0.08 0.00 -2.06 0.00 0.00 59.70 57.53 2jbf h MET 129 Cb 0.10 -0.16 -0.00 0.00 0.06 0.00 0.00 31.60 31.60 2jbf h MET 129 CO -0.02 0.89 -0.21 0.82 1.06 0.00 0.00 176.91 179.46 2jbf h ILE 130 N 0.99 1.35 -0.51 -1.22 1.08 -0.74 -1.77 117.51 116.69 2jbf h ILE 130 Ca 0.22 -1.40 0.05 0.00 -0.39 0.00 0.00 64.86 63.34 2jbf h ILE 130 Cb 0.26 1.87 -0.04 0.00 -3.07 0.00 0.00 36.82 35.84 2jbf h ILE 130 CO -0.01 0.42 0.25 0.40 -0.69 0.00 0.00 178.15 178.52 2jbf h ILE 131 N 0.07 0.95 -0.16 -0.67 2.04 -1.13 0.16 117.51 118.77 2jbf h ILE 131 Ca 0.02 -0.17 0.01 0.00 1.00 0.00 0.00 64.86 65.72 2jbf h ILE 131 Cb 0.76 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 2jbf h ILE 131 CO 0.05 0.09 0.08 -0.78 0.00 0.00 0.00 178.15 177.58 2jbf h ASP 132 N 0.49 0.11 -0.16 1.72 3.58 -1.23 0.22 116.42 121.15 2jbf h ASP 132 Ca 0.22 0.01 -0.06 0.00 0.42 0.00 0.00 57.03 57.63 2jbf h ASP 132 Cb 0.14 -0.01 -0.02 0.00 1.72 0.00 0.00 39.33 41.16 2jbf h ASP 132 CO -0.16 0.09 -0.06 -0.09 -2.88 0.00 0.00 179.24 176.14 2jbf h ARG 133 N 0.17 0.47 -0.18 0.28 9.65 -0.82 -2.27 114.38 121.68 2jbf h ARG 133 Ca 0.07 -0.11 0.00 0.00 -1.10 0.00 0.00 59.98 58.83 2jbf h ARG 133 Cb 0.02 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.53 2jbf h ARG 133 CO -0.05 0.55 0.00 1.28 2.80 0.00 0.00 179.97 184.55 2jbf n LEU 134 N -4.25 0.93 0.00 3.80 4.77 -0.00 -4.86 117.00 117.38 2jbf n LEU 134 Ca 0.01 -0.46 0.00 0.00 -0.03 0.00 0.00 56.01 55.53 2jbf n LEU 134 Cb 0.27 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.24 2jbf n LEU 134 CO 0.39 0.23 0.00 0.61 -1.33 0.00 0.00 177.39 177.29 2jbf n GLY 135 N 0.76 0.94 0.00 -0.72 0.00 -0.85 -4.66 105.19 100.66 2jbf n GLY 135 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2jbf n GLY 135 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2jbf n GLY 136 N -1.90 0.23 0.13 -0.02 0.00 0.04 -4.38 105.19 99.29 2jbf n GLY 136 Ca 0.00 -1.89 -0.10 0.00 0.00 0.00 0.00 46.02 44.04 2jbf n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbf h ALA 137 N 0.00 0.34 -0.70 4.61 0.00 -1.90 -2.30 119.26 119.31 2jbf h ALA 137 Ca 0.00 -0.06 0.07 0.00 0.00 0.00 0.00 54.91 54.93 2jbf h ALA 137 Cb 0.00 -0.11 -0.06 0.00 0.00 0.00 0.00 17.79 17.62 2jbf h ALA 137 CO 0.00 -0.14 0.37 0.00 0.00 0.00 0.00 179.25 179.48 2jbf h ALA 138 N 1.04 0.95 0.01 0.00 0.00 -1.85 0.31 119.26 119.71 2jbf h ALA 138 Ca 0.09 0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.04 2jbf h ALA 138 Cb 0.04 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2jbf h ALA 138 CO -0.02 0.02 -0.00 1.49 0.00 0.00 0.00 179.25 180.74 2jbf h GLU 139 N 0.66 -0.01 -0.80 0.00 4.57 -1.69 -1.67 114.58 115.66 2jbf h GLU 139 Ca 0.32 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.51 2jbf h GLU 139 Cb 0.26 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 28.81 2jbf h GLU 139 CO -0.22 0.10 0.53 -0.07 -1.18 0.00 0.00 179.01 178.17 2jbf h LEU 140 N -0.11 0.91 -0.65 1.64 3.38 -1.08 -2.50 115.31 116.91 2jbf h LEU 140 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 2jbf h LEU 140 Cb 0.11 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 40.60 2jbf h LEU 140 CO 0.00 0.66 0.37 0.78 0.09 0.00 0.00 178.44 180.34 2jbf h ASN 141 N 1.08 0.80 -0.57 -0.43 2.35 0.03 0.74 115.58 119.57 2jbf h ASN 141 Ca 0.29 -0.08 -0.01 0.00 -0.55 0.00 0.00 56.30 55.95 2jbf h ASN 141 Cb -0.12 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.02 2jbf h ASN 141 CO -0.06 0.65 0.32 -0.61 -1.65 0.00 0.00 177.43 176.07 2jbf h GLN 142 N 0.88 0.79 -0.53 0.81 5.75 -1.10 -1.84 115.11 119.87 2jbf h GLN 142 Ca 0.23 -0.09 0.01 0.00 -0.15 0.00 0.00 58.65 58.65 2jbf h GLN 142 Cb 0.02 -0.16 -0.03 0.00 1.07 0.00 0.00 27.48 28.39 2jbf h GLN 142 CO -0.04 0.60 0.35 0.37 -2.65 0.00 0.00 178.83 177.46 2jbf h GLN 143 N 0.77 0.69 -0.53 1.69 5.75 -0.96 -0.68 115.11 121.84 2jbf h GLN 143 Ca 0.20 -0.04 0.09 0.00 -0.15 0.00 0.00 58.65 58.75 2jbf h GLN 143 Cb 0.03 -0.16 -0.07 0.00 1.07 0.00 0.00 27.48 28.36 2jbf h GLN 143 CO -0.03 0.46 0.13 0.74 -2.65 0.00 0.00 178.83 177.48 2jbf h PHE 144 N 0.71 0.22 -0.63 3.99 0.04 -0.64 -1.39 116.94 119.25 2jbf h PHE 144 Ca 0.19 0.03 0.03 0.00 2.80 0.00 0.00 57.97 61.02 2jbf h PHE 144 Cb -0.08 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 38.02 2jbf h PHE 144 CO -0.04 0.02 0.39 1.96 -0.60 0.00 0.00 178.31 180.04 2jbf h GLN 145 N 0.28 0.75 -0.02 1.51 1.08 -0.76 -1.34 115.11 116.60 2jbf h GLN 145 Ca 0.26 -0.04 -0.03 0.00 -1.45 0.00 0.00 58.65 57.38 2jbf h GLN 145 Cb 0.34 -0.17 -0.01 0.00 -0.05 0.00 0.00 27.48 27.60 2jbf h GLN 145 CO -0.32 0.49 -0.15 0.93 -0.95 0.00 0.00 178.83 178.84 2jbf h GLU 146 N 0.77 0.04 0.00 1.46 5.08 -0.58 -0.34 114.58 121.01 2jbf h GLU 146 Ca 0.25 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.60 2jbf h GLU 146 Cb 0.01 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.25 2jbf h GLU 146 CO -0.10 0.19 0.00 0.91 -1.00 0.00 0.00 179.01 179.01 2jbf n TRP 147 N -4.35 0.00 -0.38 4.33 8.01 -0.58 -4.91 117.44 119.56 2jbf n TRP 147 Ca -0.02 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.17 2jbf n TRP 147 Cb 0.23 -0.37 0.00 0.00 -2.01 0.00 0.00 31.31 29.16 2jbf n TRP 147 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2jbf n GLY 148 N 1.01 0.80 3.54 6.99 0.00 -0.14 -4.96 105.19 112.43 2jbf n GLY 148 Ca 0.10 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2jbf n GLY 148 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jbf s LEU 149 N 0.00 3.89 0.48 0.99 1.43 -0.54 -4.88 118.68 120.05 2jbf s LEU 149 Ca 0.00 -1.70 0.20 0.00 -1.03 0.00 0.00 54.13 51.59 2jbf s LEU 149 Cb 0.00 -2.53 1.22 0.00 0.03 0.00 0.00 46.19 44.91 2jbf s LEU 149 CO 0.00 -1.37 1.98 -0.33 0.23 0.00 0.00 176.35 176.86 2jbf h GLU 150 N 9.33 0.20 0.00 1.70 5.08 -1.90 -3.08 114.58 125.91 2jbf h GLU 150 Ca 0.22 -0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.56 2jbf h GLU 150 Cb 1.00 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 30.19 2jbf h GLU 150 CO 1.36 0.13 -0.26 0.09 -1.00 0.00 0.00 179.01 179.33 2jbf n ASN 151 N -4.43 1.38 -4.30 1.42 5.03 -1.26 -5.00 115.26 108.10 2jbf n ASN 151 Ca 0.10 -2.68 -0.39 0.00 0.87 0.00 0.00 54.58 52.48 2jbf n ASN 151 Cb 0.51 -0.34 -0.11 0.00 -1.02 0.00 0.00 39.78 38.82 2jbf n ASN 151 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2jbf s THR 152 N -1.70 4.18 -0.04 3.41 2.01 -1.16 -2.45 115.64 119.89 2jbf s THR 152 Ca 0.20 -1.16 -0.01 0.00 0.31 0.00 0.00 61.69 61.03 2jbf s THR 152 Cb 0.18 -3.44 0.03 0.00 0.01 0.00 0.00 72.50 69.29 2jbf s THR 152 CO 0.00 -0.32 0.06 -0.69 -0.69 0.00 0.00 174.62 172.97 2jbf s VAL 153 N 1.45 -0.10 -0.32 3.82 1.01 -0.38 -4.79 120.40 121.10 2jbf s VAL 153 Ca 0.01 0.36 -0.22 0.00 0.00 0.00 0.00 61.98 62.12 2jbf s VAL 153 Cb -0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 36.38 36.04 2jbf s VAL 153 CO 0.04 0.15 0.74 -0.63 0.00 0.00 0.00 175.10 175.39 2jbf s ILE 154 N 1.81 4.83 -0.12 2.22 1.01 -1.26 -1.30 121.20 128.38 2jbf s ILE 154 Ca 0.00 1.03 0.11 0.00 0.00 0.00 0.00 60.65 61.80 2jbf s ILE 154 Cb -0.12 -4.11 -0.16 0.00 0.01 0.00 0.00 42.46 38.08 2jbf s ILE 154 CO -0.03 -0.25 0.06 0.59 0.00 0.00 0.00 174.94 175.31 2jbf n ASN 155 N 6.14 1.88 -3.92 3.58 3.02 -1.26 -4.74 115.26 119.95 2jbf n ASN 155 Ca 0.02 0.00 -0.10 0.00 -0.03 0.00 0.00 54.58 54.47 2jbf n ASN 155 Cb 0.48 0.86 -0.10 0.00 -0.61 0.00 0.00 39.78 40.41 2jbf n ASN 155 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 2jbf s ASN 156 N -4.50 0.16 0.96 6.41 0.01 -1.26 -5.02 114.94 111.69 2jbf s ASN 156 Ca -0.06 -0.48 -0.11 0.00 -0.71 0.00 0.00 52.86 51.50 2jbf s ASN 156 Cb 0.04 0.21 0.17 0.00 0.41 0.00 0.00 41.25 42.08 2jbf s ASN 156 CO 0.52 -0.47 1.10 -2.84 -1.51 0.00 0.00 177.10 173.91 2jbf s PRO 157 N -2.31 0.70 0.47 -0.60 0.02 -1.26 -4.79 135.00 127.23 2jbf s PRO 157 Ca -0.07 1.24 -0.17 0.00 0.02 0.00 0.00 61.00 62.02 2jbf s PRO 157 Cb -0.03 -1.71 -0.09 0.00 0.02 0.00 0.00 34.50 32.69 2jbf s PRO 157 CO -0.03 -2.75 0.95 -1.21 -0.33 0.00 0.00 177.00 173.63 2jbf s GLU 158 N -4.67 4.02 0.00 5.54 0.41 -1.26 -2.11 118.70 120.63 2jbf s GLU 158 Ca 0.66 0.95 0.18 0.00 -0.41 0.00 0.00 54.97 56.35 2jbf s GLU 158 Cb -0.22 -2.18 0.78 0.00 -1.78 0.00 0.00 34.13 30.72 2jbf s GLU 158 CO 0.59 -0.17 1.56 -0.35 -0.49 0.00 0.00 175.26 176.40 2jbf n PRO 159 N -1.24 0.05 -3.99 0.39 -0.04 -1.26 -4.83 135.00 124.07 2jbf n PRO 159 Ca 0.06 0.18 -0.34 0.00 -0.04 0.00 0.00 63.50 63.36 2jbf n PRO 159 Cb 0.54 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.49 2jbf n PRO 159 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2jbf n ASP 160 N -1.46 -2.43 0.29 3.54 2.03 -0.90 -4.84 116.55 112.77 2jbf n ASP 160 Ca 0.05 -1.15 0.16 0.00 0.52 0.00 0.00 54.79 54.38 2jbf n ASP 160 Cb 0.19 -2.46 0.85 0.00 -0.72 0.00 0.00 41.12 38.99 2jbf n ASP 160 CO 0.00 0.00 0.00 0.24 -1.92 0.00 0.00 177.20 175.52 2jbf h MET 161 N -2.08 0.00 0.00 -0.67 2.86 -1.96 -1.84 114.93 111.23 2jbf h MET 161 Ca -0.67 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 56.97 2jbf h MET 161 Cb 1.39 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.05 2jbf h MET 161 CO 0.57 0.06 0.00 1.63 1.06 0.00 0.00 176.91 180.23 2jbf n LYS 162 N -3.39 0.21 -2.84 1.72 5.02 -1.26 -4.94 118.16 112.69 2jbf n LYS 162 Ca -0.02 0.11 -0.15 0.00 -2.02 0.00 0.00 58.31 56.24 2jbf n LYS 162 Cb 0.21 -1.50 0.03 0.00 -0.02 0.00 0.00 35.03 33.74 2jbf n LYS 162 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jbf n GLY 163 N 0.46 -0.07 0.16 0.72 0.00 -0.69 -4.93 105.19 100.83 2jbf n GLY 163 Ca 0.08 -0.17 0.05 0.00 0.00 0.00 0.00 46.02 45.98 2jbf n GLY 163 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 2jbf h THR 164 N -1.07 0.73 -3.56 2.61 1.35 -1.92 -3.41 112.91 107.63 2jbf h THR 164 Ca -0.35 -1.87 -0.52 0.00 -0.55 0.00 0.00 66.41 63.13 2jbf h THR 164 Cb 1.24 2.24 0.01 0.00 -1.73 0.00 0.00 68.15 69.91 2jbf h THR 164 CO 0.37 0.39 0.50 0.20 -0.25 0.00 0.00 175.52 176.73 2jbf s ASN 165 N -6.39 7.21 0.24 5.36 0.01 -1.26 -4.55 114.94 115.56 2jbf s ASN 165 Ca 0.03 2.15 0.10 0.00 -0.71 0.00 0.00 52.86 54.44 2jbf s ASN 165 Cb 0.08 -2.61 -0.05 0.00 0.41 0.00 0.00 41.25 39.09 2jbf s ASN 165 CO 0.72 -0.26 -0.19 0.42 -1.51 0.00 0.00 177.10 176.28 2jbf s THR 166 N -0.26 2.19 0.28 1.60 -4.23 -0.42 -0.21 115.64 114.58 2jbf s THR 166 Ca 0.50 -2.25 -0.10 0.00 -1.18 0.00 0.00 61.69 58.65 2jbf s THR 166 Cb -0.31 -2.16 0.04 0.00 1.34 0.00 0.00 72.50 71.42 2jbf s THR 166 CO 0.36 -0.41 0.56 1.07 -0.54 0.00 0.00 174.62 175.66 2jbf n THR 167 N -0.34 0.00 -4.09 3.99 5.66 -0.43 -1.24 114.28 117.82 2jbf n THR 167 Ca -0.08 -0.69 -0.11 0.00 -3.05 0.00 0.00 64.05 60.12 2jbf n THR 167 Cb 0.59 0.70 -0.11 0.00 -1.55 0.00 0.00 70.33 69.96 2jbf n THR 167 CO 0.00 0.00 0.00 -0.94 -3.05 0.00 0.00 175.07 171.08 2jbf s SER 168 N -2.46 0.80 0.24 1.09 1.04 -1.26 -0.72 113.70 112.43 2jbf s SER 168 Ca 0.11 -0.77 -0.05 0.00 0.48 0.00 0.00 55.95 55.72 2jbf s SER 168 Cb -0.03 0.09 0.35 0.00 0.10 0.00 0.00 66.02 66.53 2jbf s SER 168 CO 0.08 -0.37 1.83 -0.65 0.98 0.00 0.00 173.24 175.11 2jbf h PRO 169 N 3.79 0.83 -0.66 4.02 0.11 -1.71 -1.77 132.00 136.60 2jbf h PRO 169 Ca -0.35 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 65.71 2jbf h PRO 169 Cb 1.18 -0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 2jbf h PRO 169 CO 0.53 0.55 0.41 -0.09 -0.21 0.00 0.00 178.00 179.19 2jbf h ARG 170 N 0.85 0.89 0.05 1.05 9.65 -0.98 -0.92 114.38 124.97 2jbf h ARG 170 Ca 0.38 -0.07 0.01 0.00 -1.10 0.00 0.00 59.98 59.19 2jbf h ARG 170 Cb 0.27 -0.19 -0.01 0.00 -1.39 0.00 0.00 29.97 28.64 2jbf h ARG 170 CO -0.21 0.62 -0.09 -0.44 2.80 0.00 0.00 179.97 182.66 2jbf h ASP 171 N 0.90 -0.23 0.03 -3.80 5.19 -1.65 0.35 116.42 117.21 2jbf h ASP 171 Ca 0.24 0.03 -0.00 0.00 -0.62 0.00 0.00 57.03 56.68 2jbf h ASP 171 Cb -0.05 0.09 0.00 0.00 0.18 0.00 0.00 39.33 39.55 2jbf h ASP 171 CO -0.05 -0.13 -0.01 -0.07 -3.12 0.00 0.00 179.24 175.86 2jbf h LEU 172 N -0.17 -0.03 -0.97 1.55 3.38 -1.04 -1.67 115.31 116.37 2jbf h LEU 172 Ca 0.02 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.81 2jbf h LEU 172 Cb 0.19 0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.90 2jbf h LEU 172 CO -0.05 0.16 0.61 0.00 0.09 0.00 0.00 178.44 179.25 2jbf h ALA 173 N 0.73 1.23 -0.20 1.53 0.00 -1.16 -2.37 119.26 119.03 2jbf h ALA 173 Ca -0.00 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 2jbf h ALA 173 Cb 0.21 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2jbf h ALA 173 CO 0.01 0.66 -0.48 1.15 0.00 0.00 0.00 179.25 180.58 2jbf h THR 174 N 1.32 1.32 -0.45 0.00 2.02 -0.76 0.54 112.91 116.90 2jbf h THR 174 Ca 0.35 -1.69 0.00 0.00 0.77 0.00 0.00 66.41 65.84 2jbf h THR 174 Cb -0.10 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 67.97 2jbf h THR 174 CO -0.07 0.53 0.30 0.25 0.37 0.00 0.00 175.52 176.89 2jbf h LEU 175 N 0.42 0.53 -0.76 2.58 5.85 -1.13 -0.86 115.31 121.92 2jbf h LEU 175 Ca 0.02 -0.02 -0.10 0.00 0.84 0.00 0.00 57.88 58.62 2jbf h LEU 175 Cb 0.99 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.88 2jbf h LEU 175 CO 0.09 0.39 -0.14 -0.03 -0.34 0.00 0.00 178.44 178.41 2jbf h MET 176 N 0.61 0.79 -0.32 1.25 4.05 -1.01 -2.17 114.93 118.14 2jbf h MET 176 Ca 0.17 -0.28 0.03 0.00 -0.28 0.00 0.00 59.70 59.34 2jbf h MET 176 Cb -0.06 -0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.65 2jbf h MET 176 CO -0.03 0.89 0.12 1.25 0.23 0.00 0.00 176.91 179.37 2jbf h LEU 177 N 0.71 0.14 -0.64 3.39 6.46 -0.47 0.03 115.31 124.93 2jbf h LEU 177 Ca 0.11 0.03 -0.02 0.00 -0.12 0.00 0.00 57.88 57.89 2jbf h LEU 177 Cb 0.64 0.01 -0.03 0.00 -0.73 0.00 0.00 40.66 40.55 2jbf h LEU 177 CO 0.04 0.12 0.33 0.11 -0.62 0.00 0.00 178.44 178.43 2jbf h LYS 178 N 0.26 0.91 -0.54 1.25 1.57 -0.93 -1.27 116.57 117.83 2jbf h LYS 178 Ca 0.14 -0.12 0.01 0.00 -1.87 0.00 0.00 60.65 58.81 2jbf h LYS 178 Cb 0.10 -0.17 -0.03 0.00 0.08 0.00 0.00 32.23 32.21 2jbf h LYS 178 CO -0.13 0.71 0.35 0.82 -0.57 0.00 0.00 179.45 180.62 2jbf h ILE 179 N 0.88 1.12 0.00 1.86 2.04 -1.07 0.45 117.51 122.79 2jbf h ILE 179 Ca 0.22 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 2jbf h ILE 179 Cb 0.07 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 36.49 2jbf h ILE 179 CO -0.03 0.13 -0.25 1.23 0.00 0.00 0.00 178.15 179.23 2jbf h GLY 180 N 0.71 0.00 1.38 5.37 0.00 -0.52 -0.16 103.07 109.84 2jbf h GLY 180 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2jbf h GLY 180 CO -0.06 0.00 -0.04 -1.06 0.00 0.00 0.00 176.54 175.38 2jbf n GLN 181 N -4.07 0.49 0.00 4.80 1.13 -0.52 -4.91 117.38 114.29 2jbf n GLN 181 Ca -0.02 -0.06 0.00 0.00 -1.94 0.00 0.00 57.00 54.98 2jbf n GLN 181 Cb 0.31 -1.50 0.00 0.00 0.11 0.00 0.00 30.24 29.16 2jbf n GLN 181 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2jbf n GLY 182 N 1.29 0.94 3.96 1.08 0.00 -0.07 -4.34 105.19 108.04 2jbf n GLY 182 Ca 0.14 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.94 2jbf n GLY 182 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jbf s GLU 183 N -1.00 2.96 0.00 1.61 2.02 0.12 -4.70 118.70 119.71 2jbf s GLU 183 Ca 0.00 -0.56 0.00 0.00 0.02 0.00 0.00 54.97 54.43 2jbf s GLU 183 Cb 0.00 -2.55 0.00 0.00 0.10 0.00 0.00 34.13 31.68 2jbf s GLU 183 CO 0.00 -0.35 0.00 -0.89 0.02 0.00 0.00 175.26 174.04 2jbf n ILE 184 N -2.12 0.00 -4.06 -1.63 5.41 -1.26 -3.91 119.36 111.78 2jbf n ILE 184 Ca 0.03 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.47 2jbf n ILE 184 Cb 0.58 0.00 -0.07 0.00 -0.71 0.00 0.00 39.64 39.44 2jbf n ILE 184 CO 0.00 0.00 0.00 -0.76 0.00 0.00 0.00 176.55 175.79 2jbf s LEU 185 N 0.00 3.80 0.85 1.39 1.43 -1.26 -4.87 118.68 120.02 2jbf s LEU 185 Ca 0.00 0.01 -0.12 0.00 -1.03 0.00 0.00 54.13 52.99 2jbf s LEU 185 Cb 0.00 -2.44 0.11 0.00 0.03 0.00 0.00 46.19 43.89 2jbf s LEU 185 CO 0.00 0.19 1.18 -0.94 0.23 0.00 0.00 176.35 177.01 2jbf s SER 186 N -2.27 3.33 0.20 2.29 1.04 -1.26 -4.74 113.70 112.28 2jbf s SER 186 Ca 0.28 2.28 -0.12 0.00 0.48 0.00 0.00 55.95 58.87 2jbf s SER 186 Cb -0.12 -2.58 0.23 0.00 0.10 0.00 0.00 66.02 63.65 2jbf s SER 186 CO 0.21 -2.84 1.71 -0.65 0.98 0.00 0.00 173.24 172.65 2jbf h PRO 187 N -1.31 0.22 -0.65 4.02 0.11 -1.98 -0.03 132.00 132.38 2jbf h PRO 187 Ca -0.45 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.74 2jbf h PRO 187 Cb 1.28 -0.05 -0.07 0.00 0.11 0.00 0.00 31.00 32.27 2jbf h PRO 187 CO 0.44 0.15 0.28 -0.09 -0.21 0.00 0.00 178.00 178.57 2jbf h ARG 188 N 0.23 0.48 -0.14 1.05 2.43 -2.00 -1.25 114.38 115.18 2jbf h ARG 188 Ca 0.27 -0.03 -0.15 0.00 -0.81 0.00 0.00 59.98 59.26 2jbf h ARG 188 Cb 0.39 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.83 2jbf h ARG 188 CO -0.37 0.31 -0.57 0.77 -1.51 0.00 0.00 179.97 178.61 2jbf h SER 189 N 0.49 0.48 -0.43 -3.80 0.02 -1.80 -2.25 113.55 106.26 2jbf h SER 189 Ca 0.32 -0.26 -0.00 0.00 -0.84 0.00 0.00 61.79 61.01 2jbf h SER 189 Cb 0.37 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.75 2jbf h SER 189 CO -0.29 0.95 0.26 -0.09 -1.14 0.00 0.00 176.83 176.52 2jbf h ARG 190 N 0.33 0.59 -0.33 3.45 2.43 -0.63 0.04 114.38 120.26 2jbf h ARG 190 Ca 0.00 -0.06 0.04 0.00 -0.81 0.00 0.00 59.98 59.16 2jbf h ARG 190 Cb 1.10 -0.12 -0.04 0.00 -0.42 0.00 0.00 29.97 30.48 2jbf h ARG 190 CO 0.10 0.44 0.09 -0.44 -1.51 0.00 0.00 179.97 178.65 2jbf h ASP 191 N 0.57 0.06 -0.02 -3.80 3.32 -1.15 -0.77 116.42 114.64 2jbf h ASP 191 Ca 0.15 0.05 -0.21 0.00 0.02 0.00 0.00 57.03 57.04 2jbf h ASP 191 Cb 0.01 0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.61 2jbf h ASP 191 CO -0.03 0.07 -0.77 -0.09 -1.72 0.00 0.00 179.24 176.70 2jbf h ARG 192 N 0.21 0.67 -0.17 3.56 9.65 -1.17 -0.62 114.38 126.52 2jbf h ARG 192 Ca 0.15 -0.55 0.03 0.00 -1.10 0.00 0.00 59.98 58.51 2jbf h ARG 192 Cb 0.15 0.12 -0.03 0.00 -1.39 0.00 0.00 29.97 28.81 2jbf h ARG 192 CO -0.18 1.17 -0.02 1.25 2.80 0.00 0.00 179.97 184.99 2jbf h LEU 193 N 0.46 -0.11 -0.54 3.80 6.46 -0.84 -1.02 115.31 123.51 2jbf h LEU 193 Ca -0.05 0.05 -0.10 0.00 -0.12 0.00 0.00 57.88 57.65 2jbf h LEU 193 Cb 1.39 0.09 -0.02 0.00 -0.73 0.00 0.00 40.66 41.39 2jbf h LEU 193 CO 0.15 -0.03 -0.06 -0.07 -0.62 0.00 0.00 178.44 177.80 2jbf h LEU 194 N 0.03 1.00 -0.18 2.25 3.38 -1.04 -1.23 115.31 119.51 2jbf h LEU 194 Ca 0.08 -0.33 0.03 0.00 0.09 0.00 0.00 57.88 57.75 2jbf h LEU 194 Cb 0.11 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 2jbf h LEU 194 CO -0.16 1.10 -0.04 -0.78 0.09 0.00 0.00 178.44 178.65 2jbf h ASP 195 N 0.88 -0.15 -0.59 -0.43 3.58 -0.86 -1.16 116.42 117.69 2jbf h ASP 195 Ca 0.15 0.05 0.03 0.00 0.42 0.00 0.00 57.03 57.68 2jbf h ASP 195 Cb 0.62 0.10 -0.04 0.00 1.72 0.00 0.00 39.33 41.74 2jbf h ASP 195 CO 0.04 -0.05 0.35 0.40 -2.88 0.00 0.00 179.24 177.10 2jbf h ILE 196 N 0.01 1.04 0.00 2.25 2.04 -1.06 -2.58 117.51 119.21 2jbf h ILE 196 Ca 0.08 -0.23 0.00 0.00 1.00 0.00 0.00 64.86 65.71 2jbf h ILE 196 Cb 0.12 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 36.50 2jbf h ILE 196 CO -0.17 0.12 0.00 0.23 0.00 0.00 0.00 178.15 178.33 2jbf n MET 197 N -4.77 0.05 0.00 2.37 2.81 -0.48 -1.22 117.12 115.89 2jbf n MET 197 Ca 0.06 0.17 0.14 0.00 -1.81 0.00 0.00 57.70 56.25 2jbf n MET 197 Cb 0.10 -1.58 0.49 0.00 -0.71 0.00 0.00 33.22 31.52 2jbf n MET 197 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 2jbf n ARG 198 N -1.68 0.74 -0.50 0.03 1.74 -0.47 -0.88 116.66 115.65 2jbf n ARG 198 Ca 0.05 -0.35 0.04 0.00 -0.77 0.00 0.00 57.85 56.82 2jbf n ARG 198 Cb 0.27 -1.49 0.20 0.00 -1.02 0.00 0.00 32.46 30.42 2jbf n ARG 198 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2jbf n ARG 199 N -0.82 1.83 -1.82 5.56 1.74 -0.36 -4.98 116.66 117.81 2jbf n ARG 199 Ca 0.13 -3.00 -0.31 0.00 -0.77 0.00 0.00 57.85 53.90 2jbf n ARG 199 Cb 0.31 -1.69 0.02 0.00 -1.02 0.00 0.00 32.46 30.08 2jbf n ARG 199 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2jbf s THR 200 N -3.07 4.49 -1.84 0.55 -4.23 -1.25 -4.74 115.64 105.55 2jbf s THR 200 Ca 0.39 0.81 0.20 0.00 -1.18 0.00 0.00 61.69 61.91 2jbf s THR 200 Cb 0.35 -3.76 0.53 0.00 1.34 0.00 0.00 72.50 70.97 2jbf s THR 200 CO 0.01 -1.06 1.45 1.33 -0.54 0.00 0.00 174.62 175.80 2jbf n VAL 201 N -2.84 0.89 -3.93 2.29 0.24 -0.47 -4.79 118.33 109.73 2jbf n VAL 201 Ca 0.06 -0.95 -0.31 0.00 -2.04 0.00 0.00 64.34 61.11 2jbf n VAL 201 Cb 0.54 0.60 -0.15 0.00 -1.47 0.00 0.00 33.84 33.36 2jbf n VAL 201 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 2jbf s THR 202 N -1.08 1.82 -0.15 3.34 2.01 -1.26 -4.97 115.64 115.35 2jbf s THR 202 Ca 0.42 -2.04 0.15 0.00 0.31 0.00 0.00 61.69 60.53 2jbf s THR 202 Cb 0.22 -2.35 0.41 0.00 0.01 0.00 0.00 72.50 70.78 2jbf s THR 202 CO 0.29 -0.63 1.20 0.59 -0.69 0.00 0.00 174.62 175.39 2jbf n ASN 203 N 4.45 1.52 -0.25 3.53 3.02 -1.26 -4.72 115.26 121.55 2jbf n ASN 203 Ca 0.02 -3.32 0.13 0.00 -0.03 0.00 0.00 54.58 51.38 2jbf n ASN 203 Cb 0.42 -0.46 0.44 0.00 -0.61 0.00 0.00 39.78 39.58 2jbf n ASN 203 CO 0.00 0.00 0.00 0.35 -2.62 0.00 0.00 177.26 174.99 2jbf n THR 204 N -0.69 0.00 0.00 3.41 -2.24 -1.26 -3.74 114.28 109.76 2jbf n THR 204 Ca 0.15 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 2jbf n THR 204 Cb 0.81 0.31 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 2jbf n THR 204 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2jbf n LEU 205 N -0.61 0.00 -0.23 3.22 4.77 -1.26 -4.61 117.00 118.28 2jbf n LEU 205 Ca 0.13 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.11 2jbf n LEU 205 Cb 0.33 0.00 0.11 0.00 -2.33 0.00 0.00 43.42 41.53 2jbf n LEU 205 CO 0.24 0.00 1.07 -0.07 -1.33 0.00 0.00 177.39 177.31 2jbf h LEU 206 N 0.00 0.49 -1.93 2.23 3.38 -1.87 -2.29 115.31 115.32 2jbf h LEU 206 Ca 0.00 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 2jbf h LEU 206 Cb 0.00 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 2jbf h LEU 206 CO 0.00 0.31 -0.06 -0.65 0.09 0.00 0.00 178.44 178.12 2jbf h PRO 207 N 0.63 0.00 0.00 1.13 0.11 -1.90 -2.15 132.00 129.82 2jbf h PRO 207 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 2jbf h PRO 207 Cb 0.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.37 2jbf h PRO 207 CO -0.22 0.06 0.00 0.00 -0.21 0.00 0.00 178.00 177.63 2jbf n ALA 208 N -2.50 1.56 0.54 -0.75 0.00 -0.86 -2.18 120.51 116.33 2jbf n ALA 208 Ca -0.03 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.57 2jbf n ALA 208 Cb 0.14 -1.31 0.16 0.00 0.00 0.00 0.00 19.45 18.44 2jbf n ALA 208 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2jbf n GLY 209 N -0.21 1.35 3.89 0.00 0.00 -0.81 -4.95 105.19 104.46 2jbf n GLY 209 Ca 0.02 -0.68 -0.30 0.00 0.00 0.00 0.00 46.02 45.06 2jbf n GLY 209 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2jbf s LEU 210 N -1.60 4.08 0.78 0.99 1.43 -0.92 -3.62 118.68 119.82 2jbf s LEU 210 Ca 0.32 0.83 -0.11 0.00 -1.03 0.00 0.00 54.13 54.14 2jbf s LEU 210 Cb 0.20 -3.63 0.07 0.00 0.03 0.00 0.00 46.19 42.86 2jbf s LEU 210 CO 0.29 -0.16 1.14 -0.83 0.23 0.00 0.00 176.35 177.02 2jbf s GLY 211 N -2.85 1.61 0.24 -3.19 0.00 -1.26 -4.97 107.32 96.90 2jbf s GLY 211 Ca 0.46 -0.66 -0.31 0.00 0.00 0.00 0.00 44.72 44.20 2jbf s GLY 211 CO 0.27 -0.20 1.58 0.28 0.00 0.00 0.00 173.10 175.02 2jbf n LYS 212 N -3.22 2.47 0.00 2.90 5.02 -1.26 -2.41 118.16 121.66 2jbf n LYS 212 Ca 0.08 0.88 0.00 0.00 -2.02 0.00 0.00 58.31 57.25 2jbf n LYS 212 Cb 0.61 -2.65 0.00 0.00 -0.02 0.00 0.00 35.03 32.97 2jbf n LYS 212 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2jbf n GLY 213 N 2.76 1.78 3.81 0.72 0.00 -1.26 -4.82 105.19 108.17 2jbf n GLY 213 Ca 0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.81 2jbf n GLY 213 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jbf s ALA 214 N -2.34 2.91 0.24 4.61 0.00 -1.01 -4.38 121.76 121.80 2jbf s ALA 214 Ca 0.00 0.51 0.08 0.00 0.00 0.00 0.00 51.96 52.56 2jbf s ALA 214 Cb 0.00 -3.22 -0.05 0.00 0.00 0.00 0.00 23.12 19.85 2jbf s ALA 214 CO 0.00 -0.23 -0.13 0.95 0.00 0.00 0.00 175.76 176.35 2jbf s THR 215 N -2.10 1.87 -0.16 0.00 -4.23 -0.65 -4.99 115.64 105.37 2jbf s THR 215 Ca 0.65 -2.23 -0.08 0.00 -1.18 0.00 0.00 61.69 58.86 2jbf s THR 215 Cb -0.14 -2.21 0.06 0.00 1.34 0.00 0.00 72.50 71.55 2jbf s THR 215 CO 0.20 -0.47 0.37 -0.51 -0.54 0.00 0.00 174.62 173.66 2jbf s ILE 216 N -2.89 -0.18 -0.30 2.99 2.07 -1.26 -1.35 121.20 120.28 2jbf s ILE 216 Ca 0.26 0.13 -0.15 0.00 -1.41 0.00 0.00 60.65 59.48 2jbf s ILE 216 Cb -0.00 -0.56 -0.03 0.00 0.13 0.00 0.00 42.46 42.00 2jbf s ILE 216 CO 0.10 0.06 0.38 0.00 -1.91 0.00 0.00 174.94 173.57 2jbf s ALA 217 N 1.69 3.53 0.30 1.50 0.00 -0.42 -4.32 121.76 124.04 2jbf s ALA 217 Ca -0.07 -0.98 -0.18 0.00 0.00 0.00 0.00 51.96 50.73 2jbf s ALA 217 Cb -0.10 -2.78 0.03 0.00 0.00 0.00 0.00 23.12 20.27 2jbf s ALA 217 CO -0.12 -0.86 0.71 -3.38 0.00 0.00 0.00 175.76 172.11 2jbf s HIS 218 N 2.09 -0.03 -0.10 0.00 -0.00 -0.06 -0.19 115.29 117.00 2jbf s HIS 218 Ca 0.14 -0.47 -0.04 0.00 -0.00 0.00 0.00 55.06 54.69 2jbf s HIS 218 Cb -0.16 0.67 0.05 0.00 -0.00 0.00 0.00 32.58 33.14 2jbf s HIS 218 CO 0.11 -1.30 0.21 0.21 -0.00 0.00 0.00 174.74 173.97 2jbf s LYS 219 N -3.51 0.12 0.41 -0.38 2.47 -0.48 -4.76 119.74 113.60 2jbf s LYS 219 Ca 0.14 0.56 -0.09 0.00 -1.56 0.00 0.00 55.97 55.02 2jbf s LYS 219 Cb -0.05 -0.15 -0.06 0.00 -1.46 0.00 0.00 37.83 36.11 2jbf s LYS 219 CO 0.09 -0.23 0.76 0.95 0.16 0.00 0.00 175.35 177.07 2jbf s THR 220 N 1.82 4.82 0.00 3.43 -4.23 -1.26 -2.81 115.64 117.41 2jbf s THR 220 Ca -0.03 0.53 0.02 0.00 -1.18 0.00 0.00 61.69 61.02 2jbf s THR 220 Cb -0.11 -3.75 -0.01 0.00 1.34 0.00 0.00 72.50 69.96 2jbf s THR 220 CO -0.07 -0.56 -0.06 -0.83 -0.54 0.00 0.00 174.62 172.56 2jbf s GLY 221 N -3.30 0.32 -0.18 3.99 0.00 0.42 -3.67 107.32 104.89 2jbf s GLY 221 Ca 0.50 -0.34 -0.06 0.00 0.00 0.00 0.00 44.72 44.83 2jbf s GLY 221 CO 0.33 -0.32 0.35 -0.35 0.00 0.00 0.00 173.10 173.12 2jbf s ASP 222 N -0.41 0.04 -0.14 1.64 2.15 -1.26 -0.72 116.67 117.97 2jbf s ASP 222 Ca -0.00 0.76 0.18 0.00 0.43 0.00 0.00 52.55 53.92 2jbf s ASP 222 Cb -0.04 1.08 0.34 0.00 -0.30 0.00 0.00 42.92 44.00 2jbf s ASP 222 CO -0.00 -0.24 1.21 2.30 -0.17 0.00 0.00 175.17 178.26 2jbf n ILE 223 N 5.37 1.97 0.00 4.11 -5.35 -0.43 -4.84 119.36 120.20 2jbf n ILE 223 Ca -0.07 -2.19 0.00 0.00 -0.27 0.00 0.00 62.75 60.22 2jbf n ILE 223 Cb 0.50 -0.24 0.00 0.00 -1.74 0.00 0.00 39.64 38.15 2jbf n ILE 223 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2jbf n GLY 224 N -1.25 2.22 0.10 3.28 0.00 -1.26 -4.56 105.19 103.73 2jbf n GLY 224 Ca 0.17 -0.49 0.12 0.00 0.00 0.00 0.00 46.02 45.82 2jbf n GLY 224 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2jbf n ILE 225 N 0.00 0.00 -4.23 -0.61 -5.35 -1.26 -1.17 119.36 106.74 2jbf n ILE 225 Ca 0.00 -0.05 -0.18 0.00 -0.27 0.00 0.00 62.75 62.25 2jbf n ILE 225 Cb 0.00 0.28 -0.15 0.00 -1.74 0.00 0.00 39.64 38.03 2jbf n ILE 225 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2jbf s VAL 226 N -2.80 0.55 0.02 7.28 1.01 -1.26 -0.79 120.40 124.41 2jbf s VAL 226 Ca 0.17 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 61.96 2jbf s VAL 226 Cb 0.18 -0.51 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2jbf s VAL 226 CO 0.62 0.19 -0.13 0.54 0.00 0.00 0.00 175.10 176.31 2jbf s VAL 227 N 0.27 1.05 0.23 2.92 0.11 -0.18 -1.31 120.40 123.49 2jbf s VAL 227 Ca -0.03 -0.78 -0.21 0.00 -2.93 0.00 0.00 61.98 58.03 2jbf s VAL 227 Cb -0.08 -0.92 0.07 0.00 -1.53 0.00 0.00 36.38 33.93 2jbf s VAL 227 CO -0.00 0.13 0.98 -0.83 -3.33 0.00 0.00 175.10 172.05 2jbf s GLY 228 N -0.74 0.17 -0.23 6.54 0.00 0.10 -0.16 107.32 113.00 2jbf s GLY 228 Ca 0.03 -0.43 -0.27 0.00 0.00 0.00 0.00 44.72 44.06 2jbf s GLY 228 CO 0.00 1.81 0.95 -0.35 0.00 0.00 0.00 173.10 175.51 2jbf s ASP 229 N -3.33 -0.50 -0.07 1.64 2.15 -0.41 -0.44 116.67 115.72 2jbf s ASP 229 Ca 0.20 0.84 -0.08 0.00 0.43 0.00 0.00 52.55 53.94 2jbf s ASP 229 Cb -0.03 0.81 0.02 0.00 -0.30 0.00 0.00 42.92 43.42 2jbf s ASP 229 CO 0.07 -0.25 0.22 0.00 -0.17 0.00 0.00 175.17 175.04 2jbf s ALA 230 N -0.17 -0.55 0.00 3.66 0.00 -1.12 -0.88 121.76 122.70 2jbf s ALA 230 Ca 0.00 0.51 0.00 0.00 0.00 0.00 0.00 51.96 52.47 2jbf s ALA 230 Cb -0.04 -0.27 0.00 0.00 0.00 0.00 0.00 23.12 22.81 2jbf s ALA 230 CO -0.02 -0.13 0.00 0.41 0.00 0.00 0.00 175.76 176.02 2jbf n GLY 231 N 2.61 0.97 3.17 0.00 0.00 0.70 -1.39 105.19 111.26 2jbf n GLY 231 Ca -0.15 -0.81 -0.33 0.00 0.00 0.00 0.00 46.02 44.74 2jbf n GLY 231 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2jbf s MET 232 N -1.33 3.03 -0.19 1.61 -2.45 0.73 -1.38 119.30 119.33 2jbf s MET 232 Ca 0.00 -0.85 -0.07 0.00 -1.25 0.00 0.00 55.69 53.51 2jbf s MET 232 Cb 0.00 -2.44 -0.04 0.00 1.25 0.00 0.00 34.83 33.60 2jbf s MET 232 CO 0.00 -0.02 0.06 0.08 1.05 0.00 0.00 175.02 176.20 2jbf s VAL 233 N 0.82 4.76 -0.28 10.11 1.01 0.81 -1.30 120.40 136.33 2jbf s VAL 233 Ca -0.07 -0.04 -0.09 0.00 0.00 0.00 0.00 61.98 61.78 2jbf s VAL 233 Cb -0.15 -3.15 -0.02 0.00 0.00 0.00 0.00 36.38 33.06 2jbf s VAL 233 CO -0.02 0.45 0.12 -1.81 0.00 0.00 0.00 175.10 173.85 2jbf s ASP 234 N 0.44 5.44 0.23 3.32 1.01 -0.46 -0.76 116.67 125.89 2jbf s ASP 234 Ca 0.03 -0.33 -0.14 0.00 0.71 0.00 0.00 52.55 52.82 2jbf s ASP 234 Cb -0.13 -1.98 -0.08 0.00 1.01 0.00 0.00 42.92 41.74 2jbf s ASP 234 CO 0.01 -0.11 0.63 -0.04 0.21 0.00 0.00 175.17 175.87 2jbf s MET 235 N 1.63 3.99 0.63 8.23 -1.94 0.33 -1.64 119.30 130.52 2jbf s MET 235 Ca 0.06 0.55 0.39 0.00 -1.71 0.00 0.00 55.69 54.97 2jbf s MET 235 Cb -0.16 -2.70 2.14 0.00 2.01 0.00 0.00 34.83 36.12 2jbf s MET 235 CO 0.06 0.33 2.30 -1.00 -0.01 0.00 0.00 175.02 176.69 2jbf h PRO 236 N 2.87 0.00 0.00 2.03 0.13 -1.87 0.48 132.00 135.64 2jbf h PRO 236 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 2jbf h PRO 236 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2jbf h PRO 236 CO 0.66 0.01 0.00 0.27 -0.23 0.00 0.00 178.00 178.71 2jbf n ASN 237 N -3.33 0.00 0.00 1.44 0.23 -1.26 -4.88 115.26 107.46 2jbf n ASN 237 Ca -0.03 -0.81 0.00 0.00 -0.53 0.00 0.00 54.58 53.22 2jbf n ASN 237 Cb 0.10 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.80 2jbf n ASN 237 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2jbf n GLY 238 N 0.33 0.52 3.84 4.83 0.00 0.16 -5.06 105.19 109.81 2jbf n GLY 238 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 2jbf n GLY 238 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2jbf s GLN 239 N -0.86 4.04 -0.05 1.61 -0.21 -1.25 -4.83 119.66 118.11 2jbf s GLN 239 Ca 0.00 0.98 0.03 0.00 0.02 0.00 0.00 55.36 56.39 2jbf s GLN 239 Cb 0.00 -2.17 0.00 0.00 1.00 0.00 0.00 33.01 31.84 2jbf s GLN 239 CO 0.00 -0.16 -0.14 0.50 -2.12 0.00 0.00 175.29 173.36 2jbf s ARG 240 N -3.72 1.65 0.04 2.91 3.52 -1.26 -0.51 118.95 121.58 2jbf s ARG 240 Ca 0.59 -0.49 -0.01 0.00 -0.13 0.00 0.00 55.73 55.69 2jbf s ARG 240 Cb -0.10 -1.41 -0.04 0.00 -1.56 0.00 0.00 34.95 31.85 2jbf s ARG 240 CO 0.25 0.14 -0.03 1.52 -0.81 0.00 0.00 175.30 176.37 2jbf s TYR 241 N 0.31 0.47 0.12 5.12 1.13 0.06 -1.08 117.35 123.48 2jbf s TYR 241 Ca -0.08 -0.97 0.04 0.00 -1.41 0.00 0.00 57.07 54.65 2jbf s TYR 241 Cb -0.13 -0.35 -0.04 0.00 -1.10 0.00 0.00 41.96 40.34 2jbf s TYR 241 CO 0.03 -0.35 0.12 0.14 -2.51 0.00 0.00 175.55 172.98 2jbf s VAL 242 N -3.47 4.54 -0.14 -3.49 -7.23 -0.24 -0.13 120.40 110.24 2jbf s VAL 242 Ca 0.03 -0.92 -0.09 0.00 -1.81 0.00 0.00 61.98 59.19 2jbf s VAL 242 Cb 0.05 -3.26 0.05 0.00 0.56 0.00 0.00 36.38 33.78 2jbf s VAL 242 CO -0.08 0.00 0.35 0.00 -0.31 0.00 0.00 175.10 175.06 2jbf s ALA 243 N -1.58 -0.88 -0.14 1.32 0.00 -0.48 -1.65 121.76 118.35 2jbf s ALA 243 Ca 0.30 1.22 -0.12 0.00 0.00 0.00 0.00 51.96 53.37 2jbf s ALA 243 Cb -0.11 -0.74 0.04 0.00 0.00 0.00 0.00 23.12 22.31 2jbf s ALA 243 CO 0.23 -0.21 0.36 0.00 0.00 0.00 0.00 175.76 176.13 2jbf s ALA 244 N 0.93 -0.89 -0.12 0.00 0.00 -0.42 -0.22 121.76 121.04 2jbf s ALA 244 Ca -0.06 1.07 -0.09 0.00 0.00 0.00 0.00 51.96 52.88 2jbf s ALA 244 Cb -0.07 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.46 2jbf s ALA 244 CO -0.07 -0.18 0.30 1.41 0.00 0.00 0.00 175.76 177.22 2jbf s MET 245 N 0.38 0.32 0.01 0.00 0.00 -0.06 -1.42 119.30 118.53 2jbf s MET 245 Ca -0.02 0.48 0.04 0.00 0.00 0.00 0.00 55.69 56.20 2jbf s MET 245 Cb -0.04 0.09 -0.01 0.00 0.00 0.00 0.00 34.83 34.87 2jbf s MET 245 CO -0.01 -0.08 -0.13 -1.64 0.00 0.00 0.00 175.02 173.15 2jbf s MET 246 N 0.53 0.98 -0.07 4.11 -1.94 0.08 -1.29 119.30 121.71 2jbf s MET 246 Ca -0.03 -0.58 -0.02 0.00 -1.71 0.00 0.00 55.69 53.35 2jbf s MET 246 Cb -0.05 -0.96 0.03 0.00 2.01 0.00 0.00 34.83 35.87 2jbf s MET 246 CO -0.03 0.25 0.03 0.08 -0.01 0.00 0.00 175.02 175.34 2jbf s VAL 247 N -0.54 0.15 0.17 -6.03 1.01 0.78 -1.25 120.40 114.70 2jbf s VAL 247 Ca 0.03 0.22 -0.27 0.00 0.00 0.00 0.00 61.98 61.96 2jbf s VAL 247 Cb -0.06 -0.39 -0.08 0.00 0.00 0.00 0.00 36.38 35.85 2jbf s VAL 247 CO 0.00 0.19 0.84 -0.54 0.00 0.00 0.00 175.10 175.59 2jbf s LYS 248 N 2.06 4.66 0.11 2.72 1.02 0.19 -1.01 119.74 129.50 2jbf s LYS 248 Ca 0.05 1.27 -0.18 0.00 0.02 0.00 0.00 55.97 57.13 2jbf s LYS 248 Cb -0.12 -3.28 0.04 0.00 -0.52 0.00 0.00 37.83 33.94 2jbf s LYS 248 CO -0.05 0.51 0.44 -0.98 -0.92 0.00 0.00 175.35 174.35 2jbf s ARG 249 N -0.98 1.08 0.50 1.68 1.70 0.03 -1.53 118.95 121.42 2jbf s ARG 249 Ca 0.38 -0.60 -0.22 0.00 -0.47 0.00 0.00 55.73 54.82 2jbf s ARG 249 Cb -0.24 0.48 -0.08 0.00 -0.57 0.00 0.00 34.95 34.55 2jbf s ARG 249 CO 0.28 -0.42 1.10 -2.30 -1.08 0.00 0.00 175.30 172.88 2jbf n PRO 250 N -0.11 1.37 -1.64 3.89 -0.02 -1.26 -4.39 135.00 132.83 2jbf n PRO 250 Ca -0.17 0.50 -0.57 0.00 -2.02 0.00 0.00 63.50 61.25 2jbf n PRO 250 Cb 0.63 -2.23 -0.08 0.00 -0.02 0.00 0.00 33.50 31.80 2jbf n PRO 250 CO 0.00 0.00 0.00 0.98 1.98 0.00 0.00 175.50 178.46 2jbf n TYR 251 N -0.92 1.93 -1.67 6.00 9.36 -1.26 -0.78 117.16 129.81 2jbf n TYR 251 Ca 0.10 0.53 -0.21 0.00 3.32 0.00 0.00 57.90 61.64 2jbf n TYR 251 Cb 0.43 -2.46 -0.08 0.00 -0.63 0.00 0.00 39.34 36.60 2jbf n TYR 251 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2jbf n ASN 252 N 6.19 -5.53 -4.67 2.98 5.03 -0.32 -4.93 115.26 114.01 2jbf n ASN 252 Ca 0.31 0.47 -0.42 0.00 0.87 0.00 0.00 54.58 55.81 2jbf n ASN 252 Cb 0.13 -4.84 -0.03 0.00 -1.02 0.00 0.00 39.78 34.02 2jbf n ASN 252 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 2jbf s ASP 253 N -2.73 6.53 0.36 6.41 -1.08 0.04 -4.83 116.67 121.36 2jbf s ASP 253 Ca 0.00 2.55 0.27 0.00 -0.52 0.00 0.00 52.55 54.84 2jbf s ASP 253 Cb 0.00 -2.54 1.18 0.00 -1.46 0.00 0.00 42.92 40.10 2jbf s ASP 253 CO 0.00 -0.98 1.81 1.55 0.52 0.00 0.00 175.17 178.07 2jbf h PRO 254 N 9.48 0.00 0.00 4.34 0.13 -1.91 -1.89 132.00 142.15 2jbf h PRO 254 Ca -0.45 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 64.66 2jbf h PRO 254 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2jbf h PRO 254 CO 0.94 0.00 -0.08 0.00 -0.23 0.00 0.00 178.00 178.63 2jbf h ARG 255 N 0.00 0.00 -0.27 0.86 3.08 -1.98 -1.61 114.38 114.46 2jbf h ARG 255 Ca 0.00 0.00 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 2jbf h ARG 255 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 2jbf h ARG 255 CO 0.00 0.08 -0.32 0.78 -1.07 0.00 0.00 179.97 179.44 2jbf h GLY 256 N 0.28 0.77 1.36 0.04 0.00 -1.72 -1.62 103.07 102.18 2jbf h GLY 256 Ca -0.00 -0.81 -0.16 0.00 0.00 0.00 0.00 47.33 46.35 2jbf h GLY 256 CO 0.01 0.73 -0.52 1.48 0.00 0.00 0.00 176.54 178.24 2jbf h SER 257 N 0.44 0.74 -0.58 0.19 4.64 -1.65 -2.93 113.55 114.41 2jbf h SER 257 Ca 0.04 -0.39 -0.02 0.00 -0.47 0.00 0.00 61.79 60.95 2jbf h SER 257 Cb 0.90 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 62.75 2jbf h SER 257 CO 0.08 1.13 0.28 -0.08 -0.87 0.00 0.00 176.83 177.37 2jbf h GLU 258 N 0.53 0.87 -0.66 4.77 4.57 -1.24 -2.13 114.58 121.27 2jbf h GLU 258 Ca 0.02 -0.12 -0.03 0.00 -1.18 0.00 0.00 59.36 58.06 2jbf h GLU 258 Cb 1.08 -0.16 -0.03 0.00 -0.16 0.00 0.00 28.75 29.48 2jbf h GLU 258 CO 0.11 0.68 0.31 1.25 -1.18 0.00 0.00 179.01 180.18 2jbf h LEU 259 N 0.86 0.87 -0.35 1.64 5.85 -1.17 -1.16 115.31 121.87 2jbf h LEU 259 Ca 0.21 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.78 2jbf h LEU 259 Cb 0.11 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2jbf h LEU 259 CO -0.03 0.76 0.17 0.40 -0.34 0.00 0.00 178.44 179.41 2jbf h ILE 260 N 0.92 1.16 -0.82 4.05 2.04 -1.29 -1.65 117.51 121.92 2jbf h ILE 260 Ca 0.23 -0.46 0.08 0.00 1.00 0.00 0.00 64.86 65.71 2jbf h ILE 260 Cb 0.13 0.82 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 2jbf h ILE 260 CO -0.03 0.17 0.48 0.03 0.00 0.00 0.00 178.15 178.80 2jbf h ARG 261 N 0.43 0.81 -0.28 2.37 3.08 -1.15 0.10 114.38 119.73 2jbf h ARG 261 Ca 0.12 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 59.93 2jbf h ARG 261 Cb 0.12 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.98 2jbf h ARG 261 CO -0.02 0.53 -0.56 1.96 -1.07 0.00 0.00 179.97 180.82 2jbf h GLN 262 N 0.83 0.87 -0.32 0.04 1.08 -1.00 -1.32 115.11 115.30 2jbf h GLN 262 Ca 0.38 -0.56 -0.13 0.00 -1.45 0.00 0.00 58.65 56.89 2jbf h GLN 262 Cb 0.29 0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.78 2jbf h GLN 262 CO -0.22 1.19 -0.31 0.28 -0.95 0.00 0.00 178.83 178.83 2jbf h VAL 263 N 0.67 1.29 -0.58 -0.54 2.07 -1.15 -0.63 116.25 117.39 2jbf h VAL 263 Ca 0.01 -1.47 0.10 0.00 0.82 0.00 0.00 66.70 66.16 2jbf h VAL 263 Cb 1.17 1.51 -0.08 0.00 -1.52 0.00 0.00 31.29 32.36 2jbf h VAL 263 CO 0.12 0.48 0.12 -1.28 0.02 0.00 0.00 177.57 177.04 2jbf h SER 264 N 0.55 0.01 -0.34 0.57 0.87 -0.89 -1.50 113.55 112.82 2jbf h SER 264 Ca 0.05 0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.68 2jbf h SER 264 Cb 0.88 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.97 2jbf h SER 264 CO 0.08 0.02 0.08 -0.09 -0.53 0.00 0.00 176.83 176.39 2jbf h ARG 265 N 0.26 0.54 -0.71 2.24 2.43 -1.02 -0.69 114.38 117.44 2jbf h ARG 265 Ca 0.30 -0.13 0.05 0.00 -0.81 0.00 0.00 59.98 59.38 2jbf h ARG 265 Cb 0.43 -0.07 -0.05 0.00 -0.42 0.00 0.00 29.97 29.86 2jbf h ARG 265 CO -0.38 0.60 0.42 0.52 -1.51 0.00 0.00 179.97 179.62 2jbf h MET 266 N 0.39 0.78 -0.13 0.20 2.86 -0.64 -0.99 114.93 117.39 2jbf h MET 266 Ca 0.11 -0.05 -0.05 0.00 -2.06 0.00 0.00 59.70 57.65 2jbf h MET 266 Cb 0.30 -0.18 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 2jbf h MET 266 CO 0.00 0.52 -0.12 0.28 1.06 0.00 0.00 176.91 178.65 2jbf h VAL 267 N 0.80 1.34 -0.40 -2.22 2.07 -1.18 -2.00 116.25 114.66 2jbf h VAL 267 Ca 0.30 -1.25 0.07 0.00 0.82 0.00 0.00 66.70 66.64 2jbf h VAL 267 Cb 0.10 1.87 -0.06 0.00 -1.52 0.00 0.00 31.29 31.68 2jbf h VAL 267 CO -0.14 0.37 0.03 0.22 0.02 0.00 0.00 177.57 178.06 2jbf h TYR 268 N -0.06 0.03 -0.31 1.57 5.03 -0.86 -1.46 116.97 120.91 2jbf h TYR 268 Ca 0.02 0.03 -0.09 0.00 2.58 0.00 0.00 58.73 61.27 2jbf h TYR 268 Cb 0.63 0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.95 2jbf h TYR 268 CO 0.08 -0.05 -0.18 1.96 -1.32 0.00 0.00 178.16 178.66 2jbf h GLN 269 N 0.14 0.56 -0.49 1.82 4.20 -1.18 -1.44 115.11 118.71 2jbf h GLN 269 Ca 0.20 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.67 2jbf h GLN 269 Cb 0.27 -0.05 -0.02 0.00 0.30 0.00 0.00 27.48 27.98 2jbf h GLN 269 CO -0.31 0.71 0.11 0.00 -0.67 0.00 0.00 178.83 178.67 2jbf h ALA 270 N 1.31 0.65 -0.21 3.87 0.00 -0.98 -2.35 119.26 121.55 2jbf h ALA 270 Ca 0.08 -0.22 -0.09 0.00 0.00 0.00 0.00 54.91 54.69 2jbf h ALA 270 Cb 0.59 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 2jbf h ALA 270 CO 0.04 0.35 -0.26 0.74 0.00 0.00 0.00 179.25 180.13 2jbf h PHE 271 N 0.68 0.45 0.00 0.00 0.04 -0.82 -0.43 116.94 116.85 2jbf h PHE 271 Ca 0.15 -0.09 -0.02 0.00 2.80 0.00 0.00 57.97 60.81 2jbf h PHE 271 Cb 0.35 -0.11 -0.00 0.00 2.20 0.00 0.00 35.95 38.38 2jbf h PHE 271 CO 0.02 0.63 -0.12 1.05 -0.60 0.00 0.00 178.31 179.30 2jbf h GLU 272 N 0.36 0.00 0.02 1.51 4.11 -1.09 -2.85 114.58 116.64 2jbf h GLU 272 Ca 0.05 0.00 -0.33 0.00 0.07 0.00 0.00 59.36 59.16 2jbf h GLU 272 Cb 0.65 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.84 2jbf h GLU 272 CO 0.05 0.11 -1.97 0.36 0.07 0.00 0.00 179.01 177.63 2jbf n LYS 273 N -3.13 0.67 -0.02 1.06 2.85 -0.90 -3.86 118.16 114.83 2jbf n LYS 273 Ca 0.04 0.20 0.10 0.00 -1.05 0.00 0.00 58.31 57.60 2jbf n LYS 273 Cb 0.58 -1.69 0.51 0.00 -0.65 0.00 0.00 35.03 33.77 2jbf n LYS 273 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 177.40 177.28 2jbf h LEU 274 N 0.01 0.32 0.00 -5.58 3.38 -1.13 -3.51 115.31 108.80 2jbf h LEU 274 Ca -0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.58 2jbf h LEU 274 Cb 2.07 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 42.75 2jbf h LEU 274 CO 0.06 0.21 0.00 -0.24 0.09 0.00 0.00 178.44 178.55